SCHEMBL7704604

SCHEMBL7704604

COc1ccccc1CP

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.57
TAAR1 Q96RJ0 1/20 0.57
CHRM2 P08172 4/20 0.55
CHRM1 P11229 1/20 0.55
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA7 P43166 2/20 0.55
CA9 Q16790 2/20 0.55
CA12 O43570 1/20 0.55
CA4 P22748 1/20 0.55
CA14 Q9ULX7 1/20 0.55
ALDH1A1 P00352 2/20 0.53
GAA P10253 1/20 0.53
MAPT P10636 1/20 0.53
KDM4E B2RXH2 1/20 0.53
SIGMAR1 Q99720 1/20 0.50
AOC3 Q16853 1/20 0.50
GRIN1 Q05586 3/20 0.48
GRIN2A Q12879 3/20 0.48
BCHE P06276 2/20 0.48

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 SCHEMBL27842350 0.98 IDO1 (0.59) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL27547453 0.88 IDO1 (0.47) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL5158259 0.87 IDO1 (0.50) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL28858018 0.80 TAAR1 (0.75) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL3296809 0.80 IDO1 (0.61) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL22284783 0.79 IDO1 (0.61) IDO1CA12ALDH1A1GAAMAPT
SCHEMBL27583392 0.78 IDO1 (0.59) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL17939 0.78 IDO1 (0.59) IDO1TAAR1CHRM2CHRM1CA1
Hydrochloric Acid SCHEMBL8702932 0.77 IDO1 (0.39) IDO1TAAR1CHRM2CHRM1ALDH1A1
SCHEMBL43208 0.76 IDO1 (0.61) IDO1TAAR1CHRM2CHRM1CA1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100402152-C Trimerisation of olefins using a catalyst comprising a source of chromium, molybdenum or tungsten and a ligand comprising at least one phosphorus, arsenic or antimony atom bound to at least one (hetero) hydrocarbyl group BP CHEM INT LTD (GB) 2008-07-16 CN claimed
CN-1630554-A Trimerisation of olefins using a catalyst containing chromium, molybdenum or tungsten and a ligand containing phosphorus, arsenic or antimony BP CHEM INT LTD (GB) 2005-06-22 CN claimed
CN-105813743-B The preparation of the short chain polymerization catalyst precarsor of butadiene 陶氏环球技术有限责任公司 2019-06-21 CN disclosed
CN-105504127-B Supported bimetallic polyethylene catalyst and application thereof 中国石油天然气股份有限公司 2017-09-01 CN disclosed
CN-105813743-A Butadiene telomerization catalyst precursor preparation 陶氏环球技术有限责任公司 2016-07-27 CN disclosed
CN-102300461-A Inhibitors of HCV NS5A 2011-12-28 CN disclosed
CN-100402152-C Trimerisation of olefins using a catalyst comprising a source of chromium, molybdenum or tungsten and a ligand comprising at least one phosphorus, arsenic or antimony atom bound to at least one (hetero) hydrocarbyl group BP CHEM INT LTD (GB) 2008-07-16 CN disclosed
CN-1630554-A Trimerisation of olefins using a catalyst containing chromium, molybdenum or tungsten and a ligand containing phosphorus, arsenic or antimony BP CHEM INT LTD (GB) 2005-06-22 CN disclosed
CN-1357020-A Catalyst composition and use thereof SHELL INT RESEARCH (NL) 2002-07-03 CN disclosed
EP-1192205-A1 CATALYST COMPOSITION AND USE THEREOF SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 2002-04-03 EP disclosed
CN-1311791-A Prepn. of organolithium and organophosphorus derivatives SHELL INT RESEARCH (NL) 2001-09-05 CN disclosed
EP-1102771-A2 PREPARATION OF ORGANOLITHIUM AND ORGANOPHOSPHORUS DERIVATIVES SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 2001-05-30 EP disclosed
WO-2001002463-A1 CATALYST COMPOSITION AND USE THEREOF SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2001-01-11 WO disclosed
WO-2000008030-A2 PREPARATION OF ORGANOLITHIUM AND ORGANOPHOSPHORUS DERIVATIVES SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2000-02-17 WO disclosed