SCHEMBL4078370

SCHEMBL4078370

N#Cc1ccccc1C(c1ccccc1C#N)c1ccccc1C#N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.48
ALDH1A1 P00352 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
USP8 P40818 1/20 0.39
USP7 Q93009 1/20 0.39
ESR2 Q92731 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MCL1 Q07820 1/20 0.37
KDM4E B2RXH2 2/20 0.36
HTT P42858 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
IMPDH2 P12268 3/20 0.35
IMPDH1 P20839 2/20 0.35
GAA P10253 2/20 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
SCHEMBL4098531 0.86 ALDH1A1 (0.45) TSHRALDH1A1L3MBTL1CA1CA2
SCHEMBL11604414 0.82 TSHR (0.46) TSHRALDH1A1L3MBTL1CA1CA2
SCHEMBL29835035 0.80 TSHR (0.50) TSHRALDH1A1L3MBTL1CA1CA2
SCHEMBL28715842 0.80 TSHR (0.44) TSHRALDH1A1L3MBTL1CA1CA2
SCHEMBL17465795 0.80 ALDH1A1 (0.47) TSHRALDH1A1L3MBTL1CA1CA2
SCHEMBL254017 0.80 TSHR (0.50) TSHRALDH1A1L3MBTL1CA1CA2
SCHEMBL28781263 0.80 TSHR (0.44) TSHRALDH1A1L3MBTL1CA1CA2
SCHEMBL11414735 0.80 TSHR (0.44) TSHRALDH1A1L3MBTL1CA1CA2
SCHEMBL3974692 0.80 TSHR (0.44) TSHRALDH1A1L3MBTL1CA1CA2
SCHEMBL1343672 0.80 TSHR (0.44) TSHRALDH1A1L3MBTL1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2048167-A2 First catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer Sumitomo Chemical Company, Limited (JP) 2009-04-15 EP disclosed
EP-2048170-A2 Second catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer Sumitomo Chemical Company, Limited (JP) 2009-04-15 EP disclosed
EP-2048168-A2 Process for producing catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer Sumitomo Chemical Company, Limited (JP) 2009-04-15 EP disclosed
EP-2048169-A2 Third catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer Sumitomo Chemical Company, Limited (JP) 2009-04-15 EP disclosed
US-6914108-B2 Catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-07-05 US disclosed
US-20030203810-A1 Catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED 2003-10-30 US disclosed
US-6586356-B2 Coordination catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-07-01 US disclosed
US-20010020075-A1 Catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-09-06 US disclosed
EP-1113026-A2 Catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-07-04 EP disclosed