SCHEMBL3535770

SCHEMBL3535770

COC1(Nc2cccc3c(=O)n(C)ncc23)c2ccc(C)cc2C(C)(C)CC1(O)C(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.31
KAT2B Q92831 1/20 0.31
BRD9 Q9H8M2 1/20 0.31

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
SCHEMBL4369181 0.76 NR3C1 (0.46) BRD4KAT2BBRD9
SCHEMBL3535768 0.72 NR3C1 (0.33) BRD4KAT2BBRD9
SCHEMBL3532056 0.68 NR3C1 (0.44)
SCHEMBL3530948 0.68 NR3C1 (0.47)
SCHEMBL5467747 0.67 FLT1 (0.31)
SCHEMBL5458864 0.66 EED (0.32)
SCHEMBL3538995 0.66 NR3C1 (0.47)
SCHEMBL332023 0.66 NR3C1 (0.45)
SCHEMBL3533194 0.66 NR3C1 (0.49)
SCHEMBL3529549 0.64 NR3C1 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7662821-B2 improved selectivity and pharmacokinetic properties; 6-Fluoro-1-[(1 H-indazol-4-yl)amino]-4,4-dimethyl-2-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalene-2,5-diol; cyclization of imines BAYER SCHERING PHARMA AG (DE) 2010-02-16 US claimed
US-7638515-B2 improved selectivity and pharmacokinetic properties; 6-Fluoro-1-[(1 H-indazol-4-yl)amino]-4,4-dimethyl-2-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalene-2,5-diol; cyclization of imines BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-12-29 US claimed