SCHEMBL180365

SCHEMBL180365

COc1cc2ccccc2nc1OC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 4/20 0.65
NQO2 P16083 4/20 0.53
PDGFRB P09619 1/20 0.52
PDGFRA P16234 1/20 0.52
ALDH1A1 P00352 5/20 0.51
KDM4E B2RXH2 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
BTK Q06187 1/20 0.49
HPGD P15428 4/20 0.48
MAPT P10636 2/20 0.48
GLA P06280 1/20 0.48
ACHE P22303 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
LMNA P02545 1/20 0.47
NQO1 P15559 1/20 0.45
USP2 O75604 1/20 0.44
TSHR P16473 1/20 0.44

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
Hydrochloric Acid SCHEMBL27511729 0.98 TLR8 (0.62) TLR8NQO2PDGFRBPDGFRAALDH1A1
SCHEMBL27652636 0.93 TLR8 (0.57) TLR8NQO2PDGFRBPDGFRAALDH1A1
Quinoline SCHEMBL28250283 0.88 PDGFRB (0.63) TLR8NQO2PDGFRBPDGFRAALDH1A1
SCHEMBL27530598 0.86 TLR8 (0.50) TLR8NQO2PDGFRBPDGFRAALDH1A1
SCHEMBL30989199 0.83 TLR8 (0.50) TLR8NQO2PDGFRBPDGFRAALDH1A1
SCHEMBL14280967 0.83 TLR8 (0.50) TLR8NQO2PDGFRBPDGFRAALDH1A1
SCHEMBL18023061 0.82 TLR8 (0.49) TLR8NQO2ALDH1A1KDM4ESMN1; SMN2
SCHEMBL9590284 0.82 TLR8 (0.67) TLR8NQO2PDGFRBPDGFRAALDH1A1
SCHEMBL6567448 0.81 TLR8 (0.53) TLR8NQO2PDGFRBPDGFRAALDH1A1
SCHEMBL11167917 0.81 TLR8 (0.49) TLR8NQO2ALDH1A1KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111574443-A Preparation method for degrading and removing para-fluoroaniline impurities by cabozantinib 廊坊市泽康医药科技有限公司 2020-08-25 CN claimed
CN-111533690-A Preparation method of cabozantinib defluorinated impurity 廊坊市泽康医药科技有限公司 2020-08-14 CN claimed
CN-111518027-A Preparation method of cabozantinib nitrogen oxide impurity 廊坊市泽康医药科技有限公司 2020-08-11 CN claimed
CN-111423371-A Synthesis method of cabozantinib dimer 廊坊市泽康医药科技有限公司 2020-07-17 CN claimed
CN-110283165-A 4- phenoxyquinolines and alpha-acyloxy amides compound and its preparation method and application 哈尔滨工业大学(威海) 2019-09-27 CN claimed
CN-108658856-A A kind of catalyzed by solid base prepares antitumor drug card and praises for the method for Buddhist nun's intermediate 张淑华 2018-10-16 CN claimed
CN-108525684-A A kind of preparation method of antineoplastic target medicine tivozanib intermediates 孙金霞 2018-09-14 CN claimed
CN-108083599-A For the foam Ti-base catalyst of sludge hot hydrolysis process system 北京达源环保科技有限公司 2018-05-29 CN claimed
CN-107879583-A Sludge pyrohydrolysis and anaerobic digestion integrated treatment process system 北京达源环保科技有限公司 2018-04-06 CN claimed
CN-105541798-B Quinolines Mutiple Targets kinase inhibitor with antitumor activity and preparation method thereof 中国人民解放军第二军医大学 2018-01-23 CN claimed
WO-2009118327-A1 1,4-NAPHTHOQUINONE DERIVATIVES AND THERAPEUTIC USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2009-10-01 WO claimed
CN-101293869-A Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p561lck tyrosine kinases AVENTIS PHARM PROD INC (US) 2008-10-29 CN claimed
CN-100390154-C Quinoline and quinoxaline compounds as PDGF-receptor and/or LCK tyrosine kinase inhibitors AVENTIS PHARM PROD INC (GB) 2008-05-28 CN claimed
CN-1252054-C Qinoline derivatives inhibiting effect of growth factors such as VEGF ZENECA LTD (GB) 2006-04-19 CN claimed
WO-2005087742-A1 METABOLIC KINASE MODULATORS AND METHODS OF USE AS PESTICIDES EXELIXIS, INC. (US) 2005-09-22 WO claimed
CN-1158266-C Chemical compounds 2004-07-21 CN claimed
CN-1342150-A Quinoline and quinoxaline compounds as PDGF-receptor and/or LCK tyrosine kinase inhibitors AVENTIS PHARM PROD INC (US) 2002-03-27 CN claimed
CN-1321151-A Chemical compounds ASTRAZENECA AB (SE) 2001-11-07 CN claimed
CN-1261353-A Inhibition of platelet-derived growth factor and/or p56lckQuinoline and quinoxaline compounds of tyrosine kinases RHONE POULENC RORER PHARMA (US) 2000-07-26 CN claimed
CN-1198158-A Bicyclic 4-aralkylaminopyrimidine derivatives as tyrosine kinase inhibitors PHARMACIA & UPJOHN SPA (IT) 1998-11-04 CN claimed