SCHEMBL11266925

SCHEMBL11266925

CCCCC1CCSC(Cc2ccc(Cl)cc2)(Cn2ccnc2)S1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 2/20 0.41
CYP2A6 P11509 1/20 0.40
CYP19A1 P11511 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
CYP2B6 P20813 1/20 0.40

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
SCHEMBL11259555 0.91 CYP19A1 (0.40) HMOX1CYP19A1CYP11B1CYP11B2
SCHEMBL11255210 0.91 HMOX1 (0.48) HMOX1
SCHEMBL11263880 0.91 CYP2A6 (0.39) HMOX1CYP2A6CYP19A1CYP11B1CYP11B2
SCHEMBL11261533 0.90 CYP1A2 (0.37) CYP19A1CYP11B1CYP11B2
SCHEMBL11256712 0.90 HMOX1 (0.42) HMOX1CYP2A6CYP19A1CYP11B1CYP11B2
SCHEMBL11265520 0.90 HMOX1 (0.43) HMOX1CYP2A6CYP19A1CYP11B1CYP11B2
SCHEMBL11270666 0.90 CYP2A6 (0.38) HMOX1CYP2A6CYP19A1CYP11B1CYP11B2
SCHEMBL11269411 0.90 HMOX1 (0.45) HMOX1
SCHEMBL11261168 0.89 POLB (0.37) HMOX1CYP19A1
SCHEMBL11253614 0.85 HMOX1 (0.47) HMOX1CYP2A6CYP19A1CYP11B1CYP11B2

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-4359475-A SPERMICIDES, MICROBIOCIDES OR ANTICONVULSANTS SYNTEX (U.S.A.) INC. (US) 1982-11-16 US disclosed