SCHEMBL27140298

SCHEMBL27140298

FCCCN1CCC(Oc2ccc(OCc3ccccc3)cc2)C1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 12/20 0.52
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
MCHR1 Q99705 1/20 0.50
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
CHRM2 P08172 1/20 0.47
CHRM3 P20309 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LTA4H P09960 1/20 0.46

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
SCHEMBL23475146 1.00 ESR1 (0.52) ESR1KDM4EALDH1A1LMNAMCHR1
SCHEMBL21247839 0.90 ESR1 (0.50) ESR1KDM4EALDH1A1LMNAMCHR1
SCHEMBL20165412 0.88 ESR1 (0.50) ESR1KDM4EALDH1A1LMNACHRM2
SCHEMBL20165409 0.88 ESR1 (0.50) ESR1KDM4EALDH1A1LMNACHRM2
SCHEMBL23529265 0.87 CHRM2 (0.58) ESR1CHRM2CHRM3
SCHEMBL29669585 0.86 CHRM2 (0.57) ESR1CHRM2CHRM3
SCHEMBL21247990 0.85 RAB9A (0.47) ESR1KDM4EALDH1A1LMNAMCHR1
SCHEMBL20165043 0.85 ESR1 (0.48) ESR1KDM4EALDH1A1LMNAMCHR1
SCHEMBL20165040 0.85 ESR1 (0.48) ESR1KDM4EALDH1A1LMNAMCHR1
SCHEMBL20179666 0.85 ESR1 (0.48) ESR1KDM4EALDH1A1LMNAMCHR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4577531-A1 NOVEL SUBSTITUTED 2-CARBONYL-BENZOTHIOPHENE-6- CARBOXYLIC ACID DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF Sanofi (FR) 2025-07-02 EP disclosed
WO-2024042152-A1 NOVEL SUBSTITUTED 2-CARBONYL-BENZOTHIOPHENE-6- CARBOXYLIC ACID DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF SANOFI (FR) 2024-02-29 WO disclosed