SCHEMBL22238926

SCHEMBL22238926

CC(C)CCc1cc(F)c(-c2ccc(-c3ccc(-c4ccc(-c5c(F)cc(CCC(C)C)cc5F)s4)c4nsnc34)s2)c(F)c1

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
SCHEMBL21537507 0.92 — —
SCHEMBL20806204 0.89 ESR1 (0.36) ESR1ESR2
SCHEMBL29336498 0.88 ESR1 (0.35) ESR1ESR2
SCHEMBL22021855 0.86 NOS3 (0.33) —
SCHEMBL22238959 0.84 ESR1 (0.33) ESR1ESR2
SCHEMBL17176891 0.83 SMN1; SMN2 (0.32) —
SCHEMBL21608712 0.82 ESR1 (0.34) ESR1ESR2
SCHEMBL25070556 0.82 ESR1 (0.32) ESR1ESR2
SCHEMBL22299862 0.81 SMN1; SMN2 (0.30) —
SCHEMBL19636899 0.81 SMN1; SMN2 (0.30) —

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 3 patents. 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
EP-3458549-B1 LIQUID-CRYSTAL MATERIAL MERCK PATENT GMBH (DE) 2020-07-22 — — EP disclosed
EP-3400271-B1 LIQUID-CRYSTALLINE MIXTURES MERCK PATENT GMBH (DE) 2020-07-22 — — EP disclosed
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