SCHEMBL3388511

SCHEMBL3388511

CC1=CC(c2cccc3c2ccc2ccccc23)=CC1.[LiH]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 3/20 0.44
ALDH1A1 P00352 7/20 0.38
HSD17B10 Q99714 5/20 0.38
CYP2A6 P11509 3/20 0.38
TSHR P16473 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
CYP1A2 P05177 5/20 0.37
HPGD P15428 4/20 0.37
HIF1A Q16665 3/20 0.35
MAPK1 P28482 3/20 0.35
CYP3A4 P08684 2/20 0.35
CASP1 P29466 1/20 0.35
RAB9A P51151 1/20 0.35
CASP7 P55210 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PAX8 Q06710 1/20 0.34
LMNA P02545 2/20 0.34
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.34

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
SCHEMBL28502880 0.72 HPRT1 (0.58) HPRT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL1029739 0.71 SLC6A3 (0.40) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL29769915 0.71 HPRT1 (0.78) HPRT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL593261 0.71 HPRT1 (0.78) HPRT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL29445992 0.71 HPRT1 (0.78) HPRT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL442130 0.69 HPRT1 (0.74) HPRT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL30021848 0.69 HPRT1 (0.74) HPRT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL30021505 0.69 HPRT1 (0.74) HPRT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL30103588 0.69 HPRT1 (0.74) HPRT1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL7651334 0.69 HPRT1 (0.44) HPRT1ALDH1A1HSD17B10CYP2A6TSHR

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-1803728-B1 Silylalkyl platinum (IV) compounds and their production method MOMENTIVE PERFORMANCE MAT INC (US) 2010-12-15 EP disclosed
EP-1050539-B1 Irradiation-curable silicone compositions containing photo-active platinum (IV) compounds GEN ELECTRIC (US) 2007-11-14 EP disclosed
EP-1803728-A1 Silylalkyl platinum (IV) compounds and their production method General Electric Company (US) 2007-07-04 EP disclosed
EP-1050538-B1 Irradiation-curable silicone compositions containing photo-active platinum (IV) compounds GEN ELECTRIC (US) 2004-08-04 EP disclosed
US-6451869-B1 Irradiation-curable silicone compositions, photo-active platinum (IV) compounds, and method GENERAL ELECTRIC COMPANY 2002-09-17 US disclosed
US-6150546-A AS HYDROSILYLATION CATALYST FOR EFFECTING THE CURE OF AN IRRADIATION-CURABLE SILICONE MIXTURE GENERAL ELECTRIC COMPANY (US) 2000-11-21 US disclosed
EP-1050538-A2 Irradiation-curable silicone compositions containing photo-active platinum (IV) compounds GENERAL ELECTRIC COMPANY (US) 2000-11-08 EP disclosed
EP-1050539-A2 Irradiation-curable silicone compositions containing photo-active platinum (IV) compounds GENERAL ELECTRIC COMPANY (US) 2000-11-08 EP disclosed
US-6127446-A CYCLOPENTADIENYLPLATINUM (IV) COMPOUNDS HAVING A TRISUBSTITUTED-SILYL ALIPHATIC GROUP ATTACHED TO PLATINUM BY CARBON-PLATINUM LINKAGES AS HYDROSILYLATION CATALYSTS IN IRRADIATION-CURABLE SILICONES GENERAL ELECTRIC COMPANY (US) 2000-10-03 US disclosed