SCHEMBL10199294

SCHEMBL10199294

CC(C)c1ccc2ccc(C(C)C)nc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
SCN4A P35499 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 2/20 0.39
TP53 P04637 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
HSD17B10 Q99714 1/20 0.39
LMNA P02545 2/20 0.38
TRPA1 O75762 1/20 0.36
PTGS1 P23219 1/20 0.36
CACNA1C Q13936 1/20 0.36
TYR P14679 1/20 0.36
GAA P10253 2/20 0.35
HTT P42858 2/20 0.35
UGT2B7 P16662 1/20 0.35
ALOX12 P18054 1/20 0.35

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
SCHEMBL21037203 0.87 RAB9A (0.38) NPC1RAB9ASCN4ASMN1; SMN2ALDH1A1
SCHEMBL889349 0.86 NPC1 (0.43) NPC1RAB9ASCN4ASMN1; SMN2ALDH1A1
SCHEMBL20100917 0.79 ESR1 (0.40) NPC1RAB9ASCN4ASMN1; SMN2ALDH1A1
SCHEMBL17257443 0.79 CYP1A2 (0.57) NPC1RAB9ASCN4ASMN1; SMN2KDM4E
SCHEMBL17179438 0.79 CYP1A2 (0.57) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL2609305 0.79 NR4A2 (0.47) SMN1; SMN2ALDH1A1KDM4EMEN1MAPT
SCHEMBL25756336 0.78 OGA (0.38) NPC1RAB9ASCN4ASMN1; SMN2OGA
SCHEMBL22521431 0.78 BACE1 (0.52) NPC1RAB9ASCN4ASMN1; SMN2ALDH1A1
SCHEMBL15221574 0.78 CYP1A2 (0.40) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL28268757 0.78 RAB9A (0.40) NPC1RAB9ASCN4ASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240217966-A1 PHARMACEUTICAL COMPOSITION CONTAINING GLP-1 RECEPTOR AGONIST HAVING FUSED RING SHIONOGI & CO., LTD. (JP) 2024-07-04 US disclosed
US-11738013-B2 Methods for treating hepatitis B virus infections using NS5A, NS5B or NS3 inhibitors GILEAD SCIENCES, INC. (US) 2023-08-29 US disclosed
US-11738013-B2 Methods for treating hepatitis B virus infections using NS5A, NS5B or NS3 inhibitors GILEAD SCIENCES, INC. (US) 2023-08-29 US disclosed
US-20230159573-A1 SMALL MOLECULE STAT PROTEIN DEGRADERS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-25 US disclosed
US-20230159573-A1 SMALL MOLECULE STAT PROTEIN DEGRADERS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-25 US disclosed
US-20230133504-A1 METHOD OF TREATING GRAFT-VERSUS-HOST DISEASE REGENTS OF THE UNIVERSITY OF MICHIGAN 2023-05-04 US disclosed
US-20220185831-A1 STAT3 PROTEIN DEGRADERS UNIV MICHIGAN REGENTS (US) 2022-06-16 US disclosed
US-20220117952-A1 METHODS FOR TREATING HEPATITIS B VIRUS INFECTIONS USING NS5A, NS5B OR NS3 INHIBITORS GILEAD SCIENCES, INC. 2022-04-21 US disclosed
WO-2021160132-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF 上海美悦生物科技发展有限公司 2021-08-19 WO disclosed
WO-2020205467-A1 STAT3 PROTEIN DEGRADERS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2020-10-08 WO disclosed
US-8110687-B2 Bicyclic compounds with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-02-07 US disclosed
US-20110112106-A1 TRICYCLIC INHIBITORS OF 5-LIPOXYGENASE AMIRA PHARMACEUTICALS, INC. (US) 2011-05-12 US disclosed
US-7919621-B2 Tricyclic inhibitors of 5-lipoxygenase AMIRA PHARMACEUTICALS, INC. (US) 2011-04-05 US disclosed
US-7875366-B2 as luminescent material is used a binuclear copper coordination compound having a partial structure represented by the general formula Cu-A-Cu, wherein Cu is a copper ion and A is a bidentate ligand; high efficiency CANON KABUSHIKI KAISHA (JP) 2011-01-25 US disclosed
US-7875366-B2 as luminescent material is used a binuclear copper coordination compound having a partial structure represented by the general formula Cu-A-Cu, wherein Cu is a copper ion and A is a bidentate ligand; high efficiency CANON KABUSHIKI KAISHA (JP) 2011-01-25 US disclosed
US-20070173508-A1 TRICYCLIC INHIBITORS OF 5-LIPOXYGENASE AMIRA PHARMACEUTICALS, INC. (US) 2007-07-26 US disclosed
US-20070149533-A1 Bicyclic compounds with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-06-28 US disclosed
US-20070149533-A1 Bicyclic compounds with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-06-28 US disclosed
US-20070072001-A1 Luminescent device CANON KABUSHIKI KAISHA (JP) 2007-03-29 US disclosed
US-20070072001-A1 Luminescent device CANON KABUSHIKI KAISHA (JP) 2007-03-29 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-20240217966-A1 PHARMACEUTICAL COMPOSITION CONTAINING GLP-1 RECEPTOR AGONIST HAVING FUSED RING GLP1R, GIPR, GCGR NPC1 1254/4885RAB9A 639/4885SCN4A 2283/4885
US-20070173508-A1 TRICYCLIC INHIBITORS OF 5-LIPOXYGENASE ALOX5, ALOX15, ALOX15B NPC1 1585/4885RAB9A 4190/4885SCN4A 3869/4885
US-20110112106-A1 TRICYCLIC INHIBITORS OF 5-LIPOXYGENASE ALOX5, ALOX15, ALOX15B NPC1 1585/4885RAB9A 4190/4885SCN4A 3869/4885
US-20220185831-A1 STAT3 PROTEIN DEGRADERS STAT3, JAK2, STAT5A NPC1 4173/4885RAB9A 996/4885SCN4A 2511/4885
US-11738013-B2 Methods for treating hepatitis B virus infections using NS5A, NS5B or NS3 inhibitors HAVCR2, EIF2AK2, HSP90B1 NPC1 151/4885RAB9A 1003/4885SCN4A 2793/4885
US-20220117952-A1 METHODS FOR TREATING HEPATITIS B VIRUS INFECTIONS USING NS5A, NS5B OR NS3 INHIBITORS HAVCR2, EIF2AK2, HPN NPC1 191/4885RAB9A 906/4885SCN4A 2582/4885
US-20230133504-A1 METHOD OF TREATING GRAFT-VERSUS-HOST DISEASE HLA-DRB1, CD74, HLA-C NPC1 952/4885RAB9A 3054/4885SCN4A 4739/4885
US-20070149533-A1 Bicyclic compounds with kinase inhibitory activity MAP3K20, MAP3K1, MAP3K5 NPC1 1541/4885RAB9A 2160/4885SCN4A 3338/4885
US-20230159573-A1 SMALL MOLECULE STAT PROTEIN DEGRADERS STAT1, STAT3, STAT5A NPC1 4078/4885RAB9A 1035/4885SCN4A 2913/4885

“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.