SCHEMBL4369192

SCHEMBL4369192

CC1(C)CC(O)(C(F)(F)F)C(Nn2c(=O)ccc3ccccc32)c2cccc(O)c21

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 3/20 0.41
PGR P06401 2/20 0.41
AR P10275 2/20 0.41
TRPV1 Q8NER1 2/20 0.32
CA12 O43570 1/20 0.30
BRD4 O60885 1/20 0.30
BRPF1 P55201 1/20 0.30
CA9 Q16790 1/20 0.30
KAT2B Q92831 1/20 0.30
BRD9 Q9H8M2 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
SCHEMBL4371017 0.88 NR3C1 (0.38) NR3C1PGRARTRPV1
SCHEMBL3537525 0.76 NR3C1 (0.55) NR3C1PGRAR
SCHEMBL3539690 0.76 NR3C1 (0.42) NR3C1PGRAR
SCHEMBL4368727 0.74 NR3C1 (0.49) NR3C1PGRARTRPV1
SCHEMBL4358611 0.74 NR3C1 (0.51) NR3C1PGRARTRPV1
SCHEMBL4355542 0.73 NR3C1 (0.51) NR3C1PGRARTRPV1
SCHEMBL4369052 0.73 NR3C1 (0.52) NR3C1PGRARTRPV1
SCHEMBL4361219 0.73 NR3C1 (0.48) NR3C1PGRARTRPV1
SCHEMBL4360032 0.73 NR3C1 (0.50) NR3C1PGRARTRPV1
SCHEMBL3532110 0.71 NR3C1 (0.48) NR3C1PGRARTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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