SCHEMBL21189663

SCHEMBL21189663

CC(c1ccc(C(C)(c2ccc(S)cc2S)c2ccc(S)cc2S)cc1)(c1ccc(S)cc1S)c1ccc(S)cc1S

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL22738142 0.91 PDE2A (0.35) ESR1ESR2
SCHEMBL21189657 0.90 ESR1 (0.39) ESR1ESR2
SCHEMBL21189658 0.88 KIF11 (0.41) ESR1ESR2
SCHEMBL21189420 0.81 CYP3A4 (0.38)
SCHEMBL22991305 0.79
SCHEMBL22991402 0.79
SCHEMBL22991378 0.78 KIF11 (0.31)
SCHEMBL22737598 0.74 ESR1 (0.39) ESR1ESR2
SCHEMBL21189662 0.73 ESR1 (0.44) ESR1ESR2
SCHEMBL21189661 0.73 ESR1 (0.41) ESR1ESR2

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
WO-2019142897-A1 COMPOUND, RESIN, COMPOSITION, AND PATTERN FORMING METHOD 三菱瓦斯化学株式会社 2019-07-25 WO disclosed