SCHEMBL25070490

SCHEMBL25070490

Cc1nc2c(-c3ccc(-c4ccc(CCCC(C)C)cc4F)s3)c3nsnc3c(-c3ccc(-c4ccc(CCCC(C)C)cc4F)s3)c2nc1C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 1/20 0.32
▸ GRIN2A Q12879 1/20 0.32
▸ GRIN2B Q13224 1/20 0.32
▸ GRIN2C Q14957 1/20 0.32
▸ ESR1 P03372 1/20 0.32
▸ ESR2 Q92731 1/20 0.32

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
SCHEMBL25070579 0.94 ESR1 (0.33) ESR1ESR2
SCHEMBL20176718 0.88 GCGR (0.36) ESR1ESR2
SCHEMBL25070646 0.87 ESR1 (0.34) ESR1ESR2
SCHEMBL25070452 0.86 GCGR (0.32) —
SCHEMBL25070324 0.84 ESR1 (0.30) ESR1ESR2
SCHEMBL25070457 0.84 — —
SCHEMBL18217140 0.84 GCGR (0.31) —
SCHEMBL25070660 0.83 EDNRB (0.35) ESR1ESR2
SCHEMBL22238959 0.83 ESR1 (0.33) ESR1ESR2
SCHEMBL25070556 0.82 ESR1 (0.32) 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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