SCHEMBL26539705

SCHEMBL26539705

Cc1ccc(C2=C(c3ccc(OC4CCN(CCCF)C4)cc3)c3ccc(C(=O)O)cc3CCC2)c(O)c1

nearest known ligand 0.88

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 19/20 0.88
ESR2 Q92731 1/20 0.77
AGTR2 P50052 1/20 0.76

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
SCHEMBL19273601 0.93 ESR1 (1.00) ESR1ESR2AGTR2
SCHEMBL19131502 0.93 ESR1 (1.00) ESR1ESR2AGTR2
SCHEMBL29500016 0.93 ESR1 (1.00) ESR1ESR2AGTR2
SCHEMBL23163032 0.93 ESR1 (0.86) ESR1ESR2AGTR2
SCHEMBL23162929 0.93 ESR1 (0.86) ESR1ESR2AGTR2
SCHEMBL29836629 0.93 ESR1 (0.86) ESR1ESR2AGTR2
SCHEMBL22368444 0.93 ESR1 (0.88) ESR1ESR2AGTR2
SCHEMBL23335833 0.91 ESR1 (0.89) ESR1ESR2AGTR2
SCHEMBL26539683 0.89 ESR1 (0.77) ESR1
SCHEMBL19131430 0.89 ESR1 (1.00) ESR1ESR2AGTR2

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
EP-4037768-B1 NOVEL SUBSTITUTED 6,7-DIHYDRO-5H-BENZO[7]ANNULENE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF SANOFI SA (FR) 2023-10-11 EP disclosed