SCHEMBL25070615

SCHEMBL25070615

CN(C)c1ccc(-c2ccc(-c3nnc(-c4ccc(-c5ccc(N(C)C)cc5F)s4)c4nsnc34)s2)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ APP P05067 3/20 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
SCHEMBL25070478 0.89 ESR1 (0.40) ESR1ESR2APP
SCHEMBL25070613 0.83 ESR1 (0.33) ESR1ESR2
SCHEMBL25070323 0.80 ESR1 (0.36) ESR1ESR2APP
SCHEMBL25070414 0.78 APP (0.35) ESR1ESR2APP
SCHEMBL25070577 0.77 APP (0.54) APP
SCHEMBL25070593 0.72 ESR1 (0.35) ESR1ESR2
SCHEMBL25070564 0.71 KDM4E (0.31) APP
SCHEMBL20806066 0.70 ESR1 (0.39) ESR1ESR2
SCHEMBL25070495 0.70 APP (0.56) ESR1ESR2APP
SCHEMBL19369162 0.70 ESR2 (0.46) 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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