SCHEMBL25070324

SCHEMBL25070324

CCc1nc2c(-c3ccc(-c4ccc(CCC(C)C)cc4F)s3)c3nsnc3c(-c3ccc(-c4ccc(CCC(C)C)cc4F)s3)c2nc1CC

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
SCHEMBL25070612 0.94 — —
SCHEMBL25070578 0.91 CRHR1 (0.30) —
SCHEMBL25070579 0.90 ESR1 (0.33) ESR1ESR2
SCHEMBL25070607 0.89 — —
SCHEMBL25070452 0.88 GCGR (0.32) —
SCHEMBL25070458 0.88 — —
SCHEMBL22238959 0.87 ESR1 (0.33) ESR1ESR2
SCHEMBL24990318 0.87 GCGR (0.31) —
SCHEMBL18217177 0.87 — —
SCHEMBL20176722 0.87 RARB (0.34) 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
US-20230053362-A1 DICHROIC DYE COMPOSITION MERCK PATENT GMBH (DE) 2023-02-23 — — US disclosed
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