SCHEMBL7949964

SCHEMBL7949964

CC1=Cc2c(cc(C(C)C)cc2C(C)C)[C]1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
FABP3 P05413 2/20 0.36
FABP4 P15090 2/20 0.36
FABP5 Q01469 1/20 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
SCHEMBL7940286 0.72 GABRA1 (0.39) GABRA1GABRB2
SCHEMBL3079552 0.65 GABRA1 (0.52) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL4837877 0.64 GABRA1 (0.38) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL3964697 0.63 GABRA1 (0.37) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL28407137 0.63 GABRA1 (0.37) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL11312607 0.62 FABP4 (0.50) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL11312609 0.62 FABP4 (0.50) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL4622632 0.61 GABRA1 (0.35) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL27506824 0.61 GABRA1 (0.35) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL8506274 0.61 GABRA1 (0.35) GABRA1GABRB2FABP3FABP4FABP5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6262197-B1 AS POLYMERIZATION CATALYST IN OLEFIN POLYMERIZATION TARGOR GMBH (DE) 2001-07-17 US claimed
US-6262197-B1 AS POLYMERIZATION CATALYST IN OLEFIN POLYMERIZATION TARGOR GMBH (DE) 2001-07-17 US disclosed
US-6114556-A Metallocene compound and its use as catalyst component TARGOR GMBH (DE) 2000-09-05 US disclosed
US-5962359-A Metallocene compound and its use as catalyst component TARGOR GMBH (DE) 1999-10-05 US disclosed
EP-0739897-A1 Polynuclear metallocene compound, process for preparing it and its use as catalyst HOECHST AKTIENGESELLSCHAFT (DE) 1996-10-30 EP disclosed
EP-0723971-A2 Metallocenes and their use as catalyst component HOECHST AKTIENGESELLSCHAFT (DE) 1996-07-31 EP disclosed