SCHEMBL9843925

SCHEMBL9843925

CC(C)NC(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTOR P42345 1/20 0.48
RAB9A P51151 1/20 0.48
GRM7 Q14831 1/20 0.48
GAA P10253 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CYP3A4 P08684 2/20 0.46
ALOX15 P16050 2/20 0.46
TSHR P16473 2/20 0.46
AKT1 P31749 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
TEAD4 Q15561 1/20 0.44
SIGMAR1 Q99720 1/20 0.42
TAAR1 Q96RJ0 3/20 0.41
CYP2D6 P10635 2/20 0.41
ADRA2C P18825 2/20 0.41
CHRM2 P08172 1/20 0.41
ADRA1A P35348 1/20 0.41
AOC3 Q16853 1/20 0.41
RGS12 O14924 1/20 0.41
GLA P06280 1/20 0.41

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
SCHEMBL13164341 0.89 LMNA (0.53) MTORRAB9AGRM7GAAL3MBTL1
SCHEMBL11100775 0.85 MTOR (0.44) MTORRAB9AGRM7CYP3A4ALOX15
SCHEMBL23429020 0.84 ACP3 (0.45) MTORRAB9AGRM7GAAL3MBTL1
SCHEMBL13164343 0.84 ALDH1A1 (0.54) GAACYP3A4TDP1PKMMEN1
SCHEMBL3281034 0.83 MTOR (0.57) MTORRAB9AGRM7L3MBTL1CYP3A4
SCHEMBL31067577 0.82 KDM4E (0.40) GAAL3MBTL1CYP3A4TDP1TEAD4
SCHEMBL17065061 0.82 KDM4E (0.40) GAAL3MBTL1CYP3A4TDP1TEAD4
SCHEMBL21836227 0.82 SIGMAR1 (0.55) MTORRAB9AGRM7GAAL3MBTL1
SCHEMBL21836226 0.82 SIGMAR1 (0.55) MTORRAB9AGRM7GAAL3MBTL1
SCHEMBL7991731 0.80 ADRA2C (0.48) MTORRAB9AGRM7L3MBTL1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210236539-A1 METHOD OF PROPHYLAXIS OF ZIKA VIRUS INFECTION STARPHARMA PTY LTD (AU) 2021-08-05 US disclosed
US-9636670-B2 Catalysts, ligands and use thereof OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2017-05-02 US disclosed
US-9636670-B2 Catalysts, ligands and use thereof OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2017-05-02 US disclosed
US-9636670-B2 Catalysts, ligands and use thereof OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2017-05-02 US disclosed
US-20170014419-A1 MEDICAMENT FOR SUPPRESSING MALIGNANT TUMOR METASTASIS NATIONAL CEREBRAL AND CARDIOVASCULAR CENTER (JP) 2017-01-19 US disclosed
US-20160074852-A1 CATALYSTS, LIGANDS AND USE THEREOF ISIS INNOVATION LIMITED (GB) 2016-03-17 US disclosed
US-20160074852-A1 CATALYSTS, LIGANDS AND USE THEREOF ISIS INNOVATION LIMITED (GB) 2016-03-17 US disclosed
EP-2986375-A2 CATALYSTS, LIGANDS AND USE THEREOF Isis Innovation Limited (GB) 2016-02-24 EP disclosed
WO-2014170642-A2 CATALYSTS, LIGANDS AND USE THEREOF ISIS INNOVATION LIMITED (GB) 2014-10-23 WO disclosed
WO-2014170642-A2 CATALYSTS, LIGANDS AND USE THEREOF ISIS INNOVATION LIMITED (GB) 2014-10-23 WO disclosed
US-7501404-B2 Substituted azetidinones DAIMED (US) 2009-03-10 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-20080069812-A1 Inhibitors of apoptosis proteins (IAP); antiproliferative agents; anticancer agents AEGERA THERAPEUTICS, INC. (CA) 2008-03-20 US disclosed
WO-2007104162-A1 IAP BIR DOMAIN BINDING COMPOUNDS AEGERA THERAPEUTICS, INC. (CA) 2007-09-20 WO disclosed
US-20070197522-A1 Dpp-iv inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2007-08-23 US disclosed
US-20070105832-A1 Substituted azetidinones Cadrenal Therapeutics, Inc. 2007-05-10 US disclosed
EP-0433662-A2 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-06-26 EP disclosed
US-4958029-A Process for the production of isoindoline derivatives, novel intermediates and process for their production BANYU PHARMACEUTICAL CO., LTD. (JP) 1990-09-18 US disclosed
EP-0275064-A2 Process for the production of isoindoline derivatives, novel intermediates and process for their production Banyu Pharmaceutical Co., Ltd. (JP) 1988-07-20 EP 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 (7 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-20070105832-A1 Substituted azetidinones F2R, CPA3, CFD MTOR 3646/4885RAB9A 453/4885GRM7 3307/4885
US-20160074852-A1 CATALYSTS, LIGANDS AND USE THEREOF SPR, SQOR, COASY MTOR 4164/4885RAB9A 3149/4885GRM7 3725/4885
US-20070197522-A1 Dpp-iv inhibitors DPP7, DPP4, DPP3 MTOR 3802/4885RAB9A 3070/4885GRM7 495/4885
US-20080069812-A1 Inhibitors of apoptosis proteins (IAP); antiproliferative agents; anticancer agents BIRC5, XIAP, BIRC2 MTOR 1214/4885RAB9A 1461/4885GRM7 4700/4885
US-20080207525-A1 Inhibitors of apoptosis proteins (IAP); antiproliferative agents; anticancer agents; bioavailability; coupling; chemical intermediates BIRC5, XIAP, BAX MTOR 1462/4885RAB9A 1476/4885GRM7 4738/4885
US-20170014419-A1 MEDICAMENT FOR SUPPRESSING MALIGNANT TUMOR METASTASIS AGTR2, MME, AGTR1 MTOR 1126/4885RAB9A 3461/4885GRM7 809/4885
US-20210236539-A1 METHOD OF PROPHYLAXIS OF ZIKA VIRUS INFECTION NAPA, CX3CR1, KISS1R MTOR 4506/4885RAB9A 1532/4885GRM7 84/4885

“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.