SCHEMBL1041180

SCHEMBL1041180

Clc1cc(COCc2ccccc2)ncn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
DHODH Q02127 2/20 0.39
HSP90AB1 P08238 1/20 0.37
HTT P42858 3/20 0.36
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.36
MAPK1 P28482 2/20 0.36
HPGD P15428 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
GHSR Q92847 1/20 0.36
STAT3 P40763 1/20 0.36
KDM4E B2RXH2 2/20 0.35
DAPK1 P53355 1/20 0.35
ALOX5 P09917 1/20 0.35
CYP19A1 P11511 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
SCHEMBL1041323 0.80 TSHR (0.50) TSHRSMN1; SMN2L3MBTL1NPC1RAB9A
SCHEMBL3913251 0.79 ALDH1A1 (0.52) TSHRSMN1; SMN2L3MBTL1RAB9AHSP90AB1
SCHEMBL14276269 0.77 TSHR (0.50) TSHRSMN1; SMN2L3MBTL1NPC1RAB9A
SCHEMBL5413464 0.76 ALDH1A1 (0.45) TSHRNPC1HTTALDH1A1LMNA
SCHEMBL31456568 0.76 ALDH1A1 (0.45) TSHRNPC1HTTALDH1A1LMNA
SCHEMBL23860789 0.76 TSHR (0.54) TSHRSMN1; SMN2L3MBTL1NPC1RAB9A
SCHEMBL1998718 0.74 HSP90AB1 (0.51) TSHRSMN1; SMN2L3MBTL1NPC1RAB9A
SCHEMBL18004111 0.74 TSHR (0.47) TSHRSMN1; SMN2L3MBTL1NPC1RAB9A
SCHEMBL16398644 0.73 L3MBTL1 (0.55) TSHRSMN1; SMN2L3MBTL1NPC1RAB9A
SCHEMBL18399214 0.72 TSHR (0.44) TSHRSMN1; SMN2L3MBTL1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106146473-B Anti-angiogenesis compound 宁波市方昌医药有限公司 2020-04-14 CN disclosed
EP-2997022-B1 PYRIMIDIN-4-YL-OXY-1H-INDOLE-1-CARBOXAMIDE DERIVATIVE AND ITS USE NOVARTIS AG (CH) 2018-08-29 EP disclosed
EP-2376478-B1 PYRIDYLOXYINDOLES INHIBITORS OF VEGF-R2 AND USE THEREOF FOR TREATMENT OF DISEASE NOVARTIS AG (CH) 2017-04-19 EP disclosed
US-9604969-B2 Pyrimidin-4-yl)oxy)-1h-indole-1-carboxamide derivatives and use thereof NOVARTIS AG (CH) 2017-03-28 US disclosed
US-9604969-B2 Pyrimidin-4-yl)oxy)-1h-indole-1-carboxamide derivatives and use thereof NOVARTIS AG (CH) 2017-03-28 US disclosed
US-9604969-B2 Pyrimidin-4-yl)oxy)-1h-indole-1-carboxamide derivatives and use thereof NOVARTIS AG (CH) 2017-03-28 US disclosed
CN-106188001-A A kind of Anti-angiogenic compounds 宁波市方昌医药有限公司 2016-12-07 CN disclosed
CN-106146473-A A kind of Anti-angiogenic compounds 宁波市方昌医药有限公司 2016-11-23 CN disclosed
CN-104072481-B Anti-angiogenesis compound 宁波市方昌医药有限公司 2016-08-17 CN disclosed
US-20160115156-A1 PYRIMIDIN-4-YL)OXY)-1H-INDOLE-1-CARBOXAMIDE DERIVATIVES AND USE THEREOF NOVARTIS AG (CH) 2016-04-28 US disclosed
US-20110112121-A1 Pharmaceutical Compositions and Solid Forms NOVARTIS AG (CH) 2011-05-12 US disclosed
US-20110112121-A1 Pharmaceutical Compositions and Solid Forms NOVARTIS AG (CH) 2011-05-12 US disclosed
WO-2011003858-A2 PHARMACEUTICAL COMPOSITIONS AND SOLID FORMS NOVARTIS AG (CH) 2011-01-13 WO disclosed
WO-2011003858-A2 PHARMACEUTICAL COMPOSITIONS AND SOLID FORMS NOVARTIS AG (CH) 2011-01-13 WO disclosed
US-20100168082-A1 Heterobicyclic Carboxamides as inhibitors for kinases NOVARTIS AG (CH) 2010-07-01 US disclosed
WO-2010066684-A2 Pyridyloxyindoles Inhibitors of VEGF-R2 and Use Thereof for Treatment of Disease NOVARTIS AG (CH) 2010-06-17 WO disclosed
CN-101400673-A Heterobicyclic carboxamides as kinase inhibitors NOVARTIS AG (CH) 2009-04-01 CN disclosed
US-20090030009-A1 Heterobicyclic Carboxamides as Inhibitors for Kinases NOVARTIS AG (CH) 2009-01-29 US disclosed
EP-1996578-A1 HETEROBICYCLIC CARBOXAMIDES AS INHIBITORS FOR KINASES Novartis AG (CH) 2008-12-03 EP disclosed
WO-2008009487-A1 HETEROBICYCLIC CARBOXAMIDES AS INHIBITORS FOR KINASES NOVARTIS AG (CH) 2008-01-24 WO 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 (4 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-20090030009-A1 Heterobicyclic Carboxamides as Inhibitors for Kinases PHKG1, MAP3K20, CDK2 TSHR 3579/4885SMN1; SMN2 4023/4885L3MBTL1 3804/4885
US-20100168082-A1 Heterobicyclic Carboxamides as inhibitors for kinases CDK2, PHKG1, PHKG2 TSHR 3900/4885SMN1; SMN2 4751/4885L3MBTL1 4766/4885
US-20160115156-A1 PYRIMIDIN-4-YL)OXY)-1H-INDOLE-1-CARBOXAMIDE DERIVATIVES AND USE THEREOF IDO1, IDO2, TPH1 TSHR 2839/4885SMN1; SMN2 1811/4885L3MBTL1 4319/4885
US-20110112121-A1 Pharmaceutical Compositions and Solid Forms VEGFA, FLT1, FLT4 TSHR 4199/4885SMN1; SMN2 477/4885L3MBTL1 4162/4885

“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.