SCHEMBL2018214

SCHEMBL2018214

O=C(O)CNc1ccccc1F

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL8 P10145 1/20 0.54
NPC1 O15118 5/20 0.53
RAB9A P51151 5/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
ALDH1A1 P00352 4/20 0.51
GAA P10253 2/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
PKM P14618 1/20 0.48
MAPT P10636 1/20 0.46
PARP1 P09874 1/20 0.45
EGFR P00533 1/20 0.45
MMP1 P03956 1/20 0.45
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
HTT P42858 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 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 SCHEMBL28780309 1.00 CXCL8 (0.54) CXCL8NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL28122217 0.98 CXCL8 (0.53) CXCL8NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL28847313 0.98 CXCL8 (0.53) CXCL8NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL28307658 0.98 CXCL8 (0.53) CXCL8NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL5692314 0.85 PARP1 (0.51) CXCL8RAB9ASMN1; SMN2ALDH1A1GAA
SCHEMBL188545 0.85 PARP1 (0.46) CXCL8NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL7850943 0.84 RAB9A (0.47) CXCL8NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL5966407 0.83 ALB (0.47) CXCL8NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL23361657 0.82 ALDH1A1 (0.54) CXCL8NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL30093188 0.82 ALDH1A1 (0.54) CXCL8NPC1RAB9ASMN1; 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 651 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020018839-A1 COMPOUNDS AND METHODS FOR SYNERGISTIC ACTIVATION OF M CHANNELS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-01-23 WO claimed
CN-109912439-A Method for continuously and rapidly preparing DL-phenylglycine and analogue thereof by using cyanohydrin method 禄丰天宝磷化工有限公司 2019-06-21 CN claimed
CN-109824531-A Method for continuously and rapidly preparing DL-phenylglycine and analogues thereof 禄丰天宝磷化工有限公司 2019-05-31 CN claimed
CN-106442787-B The foundation of liquid chromatogram retention index and its application in terms of compound characterization 中国烟草总公司郑州烟草研究院 2019-04-12 CN claimed
CN-105237458-B A kind of preparation method of polysubstituted indole derivatives 上海应用技术学院 2018-01-26 CN claimed
CN-104958286-B For treating the compound of disease 伊诺克西亚生命科学股份有限公司 2018-01-05 CN claimed
CN-105669618-A Preparation method of polysubstituted benzofuran derivative 上海应用技术学院 2016-06-15 CN claimed
EP-2965755-A1 COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES Inoxia Lifesciences GmbH (AT) 2016-01-13 EP claimed
CN-105237458-A Preparation method for polysubstituted indole derivatives SHANGHAI INST TECHNOLOGY 2016-01-13 CN claimed
CN-104958286-A Compounds for use in the treatment of diseases INOXIA LIFESCIENCES GMBH 2015-10-07 CN claimed
WO-2011091461-A1 COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES PLANTA NATURSTOFFE VERTRIEBSGES.M.B.H. (AT) 2011-08-04 WO claimed
CN-101565380-A Preparation method of L(+)-p-fluorophenyl glycine JIANGSU ALPHA PHARMACEUTICAL C (CN) 2009-10-28 CN claimed
CN-101368199-A Method for preparing D-aminophenol with immobilization penicillin acylated enzyme catalysis UNIV CHONGQING POSTS & TELECOM (CN) 2009-02-18 CN claimed
CN-101003822-A Method for producing D amino acid by immobilizing acylation enzyme of penicillin CHENGDU ORGANIC CHEMISTRY C A (CN) 2007-07-25 CN claimed
EP-1735312-A1 SUBSTITUTED DIAZA-SPIRO-[5.5|-UNDECANE DERIVATIVES AND THEIR USE AS NEUROKININ ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2006-12-27 EP claimed
WO-2005097795-A1 SUBSTITUTED DIAZA-SPIRO-[5.5]-UNDECANE DERIVATIVES AND THEIR USE AS NEUROKININ ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2005-10-20 WO claimed
EP-1276732-A1 AMIDES OF R-2-(AMINOARYL)-PROPIONIC ACIDS FOR USE IN THEPREVENTION OF LEUCOCYTE ACTIVATION\ Dompé S.P.A. (IT) 2003-01-22 EP claimed
WO-2001079189-A2 'AMIDES OF R-2-(AMINOARYL)-PROPIONIC ACIDS FOR USE IN THEPREVENTION OF LEUCOCYTE ACTIVATION' Dompé S.p.A. (IT) 2001-10-25 WO claimed
EP-0920307-A2 DERIVATES FROM BISARYLTETRACARBONACID, AND PHARMARCEUTICAL PRODUCT CONTAINING THEM Roche Diagnostics GmbH (DE) 1999-06-09 EP claimed
WO-1998006386-A2 DERIVATES FROM BISARYLTETRACARBONACID, AND PHARMARCEUTICAL PRODUCT CONTAINING THEM ROCHE DIAGNOSTICS GMBH (DE) 1998-02-19 WO claimed