SCHEMBL9846121

SCHEMBL9846121

CCc1cc(C=Cc2cc3c(Cl)ccc(Cl)c3o2)c(OC)nc1C

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.30
RARA P10276 1/20 0.30
RARB P10826 1/20 0.30
RARG P13631 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
SCHEMBL9846119 1.00 TTR (0.30) TTRRARARARBRARG
SCHEMBL9846323 0.81
SCHEMBL9846324 0.81
SCHEMBL9846106 0.75 PDE4A (0.34) RARARARBRARG
SCHEMBL9846426 0.73 PDE4A (0.35) RARARARBRARG
SCHEMBL9846156 0.73 ALOX5 (0.31)
SCHEMBL9846211 0.72 ELANE (0.31)
SCHEMBL9432062 0.72 ELANE (0.31)
SCHEMBL9267418 0.69 ALDH1A1 (0.39)
SCHEMBL9846194 0.68 PDE3B (0.36)

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-0462800-A2 Inhibitors of HIV reverse transcriptase MERCK & CO. INC. (US) 1991-12-27 EP disclosed