SCHEMBL3271284

SCHEMBL3271284

CC(C)NCc1ccc(CNC(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.48
▸ LTA4H P09960 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ PARP1 P09874 4/20 0.45
▸ ALDH1A1 P00352 3/20 0.44
▸ SLC2A1 P11166 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ LMNA P02545 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ HRH1 P35367 1/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ ITGB1 P05556 1/20 0.39
▸ ITGA5 P08648 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CASR P41180 1/20 0.39
▸ ALOX15 P16050 1/20 0.38
▸ PTGS2 P35354 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13164692 0.92 ALDH1A1 (0.49) SIGMAR1LTA4HSMN1; SMN2PARP1ALDH1A1
SCHEMBL3440308 0.90 LOXL2 (0.50) SIGMAR1LTA4HSMN1; SMN2PARP1ALDH1A1
SCHEMBL8443205 0.90 LMNA (0.48) SIGMAR1LTA4HSMN1; SMN2PARP1ALDH1A1
SCHEMBL8851013 0.90 SMN1; SMN2 (0.58) SIGMAR1LTA4HSMN1; SMN2PARP1ALDH1A1
SCHEMBL24999530 0.88 SIGMAR1 (0.41) SIGMAR1LTA4HSMN1; SMN2PARP1ALDH1A1
SCHEMBL2548456 0.88 PYCR1 (0.48) SIGMAR1ALDH1A1LMNACYP1A2CYP2C19
SCHEMBL7855536 0.88 CYP2C19 (0.53) SMN1; SMN2POLBCYP1A2CYP2C19CYP2D6
SCHEMBL14549210 0.88 TPSAB1 (0.45) SIGMAR1LTA4HSMN1; SMN2PARP1SLC2A1
SCHEMBL6613714 0.88 ITGB1 (0.53) SIGMAR1LTA4HSMN1; SMN2PARP1ALDH1A1
SCHEMBL16869918 0.88 SIGMAR1 (0.50) SIGMAR1LTA4HALDH1A1LMNAPTGS2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023244918-A1 QUINOLONE BCL6 BIFUNCTIONAL DEGRADERS Treeline Biosciences, Inc. (US) 2023-12-21 — — WO disclosed
US-20210388196-A1 GENE DELIVERY CARRIER MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2021-12-16 — — US disclosed
US-11041069-B2 Gene delivery carrier MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2021-06-22 — — US disclosed
US-20190194444-A1 GENE DELIVERY CARRIER POLITECNICO DI MILANO (IT) 2019-06-27 — — US disclosed
US-20190169084-A1 CONJUGATES DERIVED FROM NON-STEROIDAL ANTI-INFLAMMATORY DRUGS AND METHODS OF USE THEREOF IN IMAGING Reiley Pharmaceuticals, Inc. 2019-06-06 — — US disclosed
US-9365614-B2 IAP BIR domain binding compounds PHARMASCIENCE INC. (CA) 2016-06-14 — — US disclosed
US-20150374858-A1 CONJUGATES DERIVED FROM NON-STEROIDAL ANTI-INFLAMMATORY DRUGS AND METHODS OF USE THEREOF IN IMAGING Reiley Pharmaceuticals, Inc. 2015-12-31 — — US disclosed
US-20140336134-A1 IAP BIR Domain Binding Compounds PHARMASCIENCE INC. (CA) 2014-11-13 — — US disclosed
US-8765681-B2 IAP BIR domain binding compounds PHARMASCIENCE INC. (CA) 2014-07-01 — — US disclosed
US-8754237-B2 Bifunctional histone deacetylase inhibitors PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2014-06-17 — — US disclosed
US-20080207525-A1 Inhibitors of apoptosis proteins (IAP); antiproliferative agents; anticancer agents; bioavailability; coupling; chemical intermediates PHARMASCIENCE INC. (CA) 2008-08-28 — — US disclosed
US-20080069812-A1 Inhibitors of apoptosis proteins (IAP); antiproliferative agents; anticancer agents AEGERA THERAPEUTICS, INC. (CA) 2008-03-20 — — US disclosed
US-6992034-B2 Catalyst component for olefin polymerization FORMOSA PLASTICS CORPORATION, U.S.A. (US) 2006-01-31 — — US disclosed
US-6939963-B2 Method for the preparation of selectively-substituted corroles and new substituted corroles TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2005-09-06 — — US disclosed
EP-1411927-A4 METHOD FOR THE PREPARATION OF SELECTIVELY-SUBSTITUTED CORROLES AND NEW SUBSTITUTED CORROLES TECHNION RES & DEV FOUNDATION (IL) 2005-04-20 — — EP disclosed
US-20050009690-A1 Catalyst component for olefin polymerization FORMOSA PLASTICS CORPORATIONS, U.S.A. 2005-01-13 — — US disclosed
US-20040180872-A1 Use as catalyst , in photovoltaic cells, drugs for diagnosis and photodynamic treatment of tumors or as chemical intermediates; metal complexes of 2,17-Bis(chlorosulfonyl)-5,10,15-tris(pentafluorophenyl)corrole TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2004-09-16 — — US disclosed
EP-1411927-A1 METHOD FOR THE PREPARATION OF SELECTIVELY-SUBSTITUTED CORROLES AND NEW SUBSTITUTED CORROLES Technion Research and Development Foundation Ltd. (IL) 2004-04-28 — — EP disclosed
WO-2003004021-A1 METHOD FOR THE PREPARATION OF SELECTIVELY-SUBSTITUTED CORROLES AND NEW SUBSTITUTED CORROLES TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2003-01-16 — — WO disclosed
US-3943158-A POLYURETHANE MONOMERS BAYER AKTIENGESELLSCHAFT (DT) 1976-03-09 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190194444-A1 GENE DELIVERY CARRIER PAICS, PBDC1, BCAT1 SIGMAR1 4663/4885LTA4H 1361/4885SMN1; SMN2 3124/4885
US-20140336134-A1 IAP BIR Domain Binding Compounds BIRC2, BIRC7, BIRC5 SIGMAR1 4744/4885LTA4H 3443/4885SMN1; SMN2 2818/4885
US-11041069-B2 Gene delivery carrier PAICS, PBDC1, BCAT1 SIGMAR1 4663/4885LTA4H 1361/4885SMN1; SMN2 3124/4885
US-20150374858-A1 CONJUGATES DERIVED FROM NON-STEROIDAL ANTI-INFLAMMATORY DRUGS AND METHODS OF USE THEREOF IN IMAGING PTGES3, PTGES, HPGDS SIGMAR1 76/4885LTA4H 32/4885SMN1; SMN2 4033/4885
US-20080069812-A1 Inhibitors of apoptosis proteins (IAP); antiproliferative agents; anticancer agents BIRC5, XIAP, BIRC2 SIGMAR1 4339/4885LTA4H 4702/4885SMN1; SMN2 1543/4885
US-20210388196-A1 GENE DELIVERY CARRIER PAICS, PBDC1, BCAT1 SIGMAR1 4663/4885LTA4H 1361/4885SMN1; SMN2 3124/4885
US-20190169084-A1 CONJUGATES DERIVED FROM NON-STEROIDAL ANTI-INFLAMMATORY DRUGS AND METHODS OF USE THEREOF IN IMAGING PTGES3, PTGES, HPGDS SIGMAR1 76/4885LTA4H 32/4885SMN1; SMN2 4033/4885
US-20040180872-A1 Use as catalyst , in photovoltaic cells, drugs for diagnosis and photodynamic treatment of tumors or as chemical intermediates; metal complexes of 2,17-Bis(chlorosulfonyl)-5,10,15-tris(pentafluorophenyl)corrole EPOR, NR2E3, CBR1 SIGMAR1 197/4885LTA4H 3220/4885SMN1; SMN2 3036/4885
US-20080207525-A1 Inhibitors of apoptosis proteins (IAP); antiproliferative agents; anticancer agents; bioavailability; coupling; chemical intermediates BIRC5, XIAP, BAX SIGMAR1 4230/4885LTA4H 4710/4885SMN1; SMN2 890/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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