SCHEMBL109654

SCHEMBL109654

Cc1cc(Cl)ccc1C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.63
TSHR P16473 2/20 0.63
CASP1 P29466 1/20 0.63
MYC P01106 2/20 0.58
ALDH1A1 P00352 2/20 0.57
TP53 P04637 1/20 0.57
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
NR4A1 P22736 1/20 0.53
FLT1 P17948 1/20 0.51
FLT4 P35916 1/20 0.51
KDR P35968 1/20 0.51
KDM4E B2RXH2 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
SRD5A2 P31213 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TRPM4 Q8TD43 1/20 0.49
ALOX15 P16050 1/20 0.48
PPARG P37231 1/20 0.47

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 SCHEMBL14660084 0.98 SMN1; SMN2 (0.61) SMN1; SMN2TSHRCASP1MYCALDH1A1
SCHEMBL5704424 0.88 ABL1 (0.58) SMN1; SMN2TSHRCASP1MYCALDH1A1
SCHEMBL250256 0.84 FLT1 (0.53) SMN1; SMN2TSHRCASP1MYCALDH1A1
SCHEMBL10024263 0.84 RXRB (0.58) SMN1; SMN2TSHRCASP1MYCALOX15
SCHEMBL28674889 0.83 ALDH1A1 (0.50) SMN1; SMN2TSHRCASP1MYCALDH1A1
SCHEMBL402387 0.83 ALDH1A1 (0.63) SMN1; SMN2TSHRCASP1MYCALDH1A1
SCHEMBL4574528 0.83 FLT1 (0.51) SMN1; SMN2TSHRCASP1MYCFLT1
SCHEMBL30628195 0.83 FLT1 (0.51) SMN1; SMN2TSHRCASP1MYCFLT1
SCHEMBL107882 0.83 FLT1 (0.51) SMN1; SMN2TSHRCASP1MYCALDH1A1
SCHEMBL2468739 0.81 KDM4E (0.55) SMN1; SMN2TSHRCASP1ALDH1A1FLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116836081-A Ether epoxy toughening agent and preparation method and application thereof 中国林业科学研究院林产化学工业研究所 2023-10-03 CN claimed
EP-3551634-A1 SUBSTITUTED PYRAZOLOAZEPIN-8-ONES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS Leo Pharma A/S (DK) 2019-10-16 EP claimed
CN-110088108-A SUBSTITUTED PYRAZOLOAZEPIN-4-ONES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS 利奥制药有限公司 2019-08-02 CN claimed
WO-2018108231-A1 SUBSTITUTED PYRAZOLOAZEPIN-8-ONES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2018-06-21 WO claimed
CN-103058913-B The synthetic method of 5-chlorine isoindolone CHEMFUTURE PHARMATECH (JIANGSU), LTD. (CN) 2015-09-30 CN claimed
CN-103450154-A Double amide derivative containing sulfur ether and N-sulfur cyano (sulphone) imine structure and replacing pyrazolecarboxamide and preparing method and purpose thereof UNIV NANKAI 2013-12-18 CN claimed
US-8569195-B2 Internal and external donor compounds for olefin polymerization catalysts II BASF CORPORATION (US) 2013-10-29 US claimed
CN-103058913-A Method for synthesizing 5-isoindolone chloride CHEMFUTURE PHARMATECH JIANGSU CO LTD 2013-04-24 CN claimed
EP-2539375-A2 INTERNAL AND EXTERNAL DONOR COMPOUNDS FOR OLEFIN POLYMERIZATION CATALYSTS II BASF Corporation (US) 2013-01-02 EP claimed
WO-2011106480-A2 INTERNAL AND EXTERNAL DONOR COMPOUNDS FOR OLEFIN POLYMERIZATION CATALYSTS II BASF CORPORATION (US) 2011-09-01 WO claimed
EP-1098866-A1 METHOD FOR PRODUCING ORTHO-ALKYLATED BENZOIC ACID DERIVATIVES MERCK PATENT GmbH (DE) 2001-05-16 EP claimed
WO-2000005187-A1 METHOD FOR PRODUCING ORTHO-ALKYLATED BENZOIC ACID DERIVATIVES MERCK PATENT GMBH (DE) 2000-02-03 WO claimed
EP-0081384-B1 PROCESS FOR THE PREPARATION OF AROMATIC OR HETEROAROMATIC CARBOXYLATED COMPOUNDS Montedison S.p.A. (IT) 1986-04-02 EP claimed
US-4397763-A TITANIUM-BASED PHILLIPS PETROLEUM COMPANY (US) 1983-08-09 US claimed
US-4330648-A MIXTURE OF TITANIUM HALIDE, MAGNESIUM OR MANGANOUS CHLORIDE DIHYDROCARBYLALUMINUM HALIDE OR HYDRIDE AND AN ETHER-ALCOHOL PHILLIPS PETROLEUM COMPANY (US) 1982-05-18 US claimed
US-4312784-A TITANIUM HALIDE, LEWIS BASE, MAGNESIUM OR MANGANOUS CHLORIDE, UNSATURATED HYDROCARBON AND TRIHYDROCARBYLALUMNIUM PHILLIPS PETROLEUM CO. (US) 1982-01-26 US claimed
US-4242480-A TWO OR THREE COMPONENT SYSTEM COMPRISING A TITANIUM HALIDE, LEWIS BASE, MAGNESIUM OR MANGANESE CHLORIDE, UNSATURATED HYDROCARBON, ORGANOALUMINUM COMPOUND PHILLIPS PETROLEUM COMPANY (US) 1980-12-30 US claimed
US-4180679-A HERBICIDES AMERICAN CYANAMID COMPANY (US) 1979-12-25 US claimed
EP-0002522-A1 Process for polymerizing butene-1 PHILLIPS PETROLEUM COMPANY (US) 1979-06-27 EP claimed
EP-0002521-A1 Titanium-magnesium/manganese-aluminum catalyst and process for olefin polymerization PHILLIPS PETROLEUM COMPANY (US) 1979-06-27 EP claimed