SCHEMBL7937906

SCHEMBL7937906

CC1(C)Cc2cc3c(cc2C(C)(C)C1)CCC3=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PBRM1 Q86U86 1/20 0.39
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
BRD4 O60885 1/20 0.32
HSD17B1 P14061 2/20 0.32
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.31
TYMS P04818 1/20 0.30
GRM5 P41594 1/20 0.30
PTGS2 P35354 1/20 0.30

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
SCHEMBL8447443 0.81 PBRM1 (0.44) MEN1MAPK1KMT2ANPSR1PBRM1
SCHEMBL22982478 0.79 MEN1 (0.56) MEN1MAPK1KMT2ANPSR1PBRM1
SCHEMBL29661202 0.79 MEN1 (0.56) MEN1MAPK1KMT2ANPSR1PBRM1
SCHEMBL7624438 0.74 PBRM1 (0.44) MEN1MAPK1KMT2ANPSR1PBRM1
SCHEMBL8308277 0.71 MEN1 (0.51) MEN1MAPK1KMT2ANPSR1HSD17B1
SCHEMBL27691769 0.68 MEN1 (0.56) MEN1MAPK1KMT2ANPSR1PBRM1
SCHEMBL20681358 0.68 MEN1 (0.54) MEN1MAPK1KMT2ANPSR1PBRM1
SCHEMBL6915238 0.65 MEN1 (0.51) MEN1MAPK1KMT2ANPSR1HSD17B1
SCHEMBL11111147 0.63 MEN1 (0.59) MEN1MAPK1KMT2ANPSR1PBRM1
SCHEMBL179913 0.63 MEN1 (0.64) MEN1MAPK1KMT2ANPSR1PBRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946575-B1 FUSED RING SUBSTITUTED INDENYL METAL COMPLEXES AND POLYMERIZATION PROCESS DOW CHEMICAL CO (US) 2001-10-10 EP disclosed
US-6034022-A COORDINATION POLYMERIZATION CATALYST THE DOW CHEMICAL COMPANY (US) 2000-03-07 US disclosed
US-5965756-A COORDINATION CATALYSTS AS ADDITION POLYMERIZATION CATALYSTS THE DOW CHEMICAL COMPANY (US) 1999-10-12 US disclosed
EP-0946575-A1 FUSED RING SUBSTITUTED INDENYL METAL COMPLEXES AND POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1999-10-06 EP disclosed
WO-1998027103-A1 FUSED RING SUBSTITUTED INDENYL METAL COMPLEXES AND POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1998-06-25 WO disclosed