SCHEMBL11258554

SCHEMBL11258554

CC1CSC(Cc2ccc(Cl)cc2)(Cn2ccnc2)SC1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 2/20 0.50
CYP2A6 P11509 1/20 0.49
CYP19A1 P11511 1/20 0.49
CYP11B1 P15538 1/20 0.49
CYP11B2 P19099 1/20 0.49
CYP2B6 P20813 1/20 0.49

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
SCHEMBL11266730 0.89 HMOX1 (0.49) HMOX1CYP2A6CYP19A1CYP11B1CYP11B2
SCHEMBL11270241 0.88 HMOX1 (0.59) HMOX1
SCHEMBL11257241 0.88 CYP2A6 (0.47) HMOX1CYP2A6CYP19A1CYP11B1CYP11B2
SCHEMBL11257432 0.88 CYP2A6 (0.47) HMOX1CYP2A6CYP19A1CYP11B1CYP11B2
SCHEMBL11261964 0.88 CYP19A1 (0.48) HMOX1CYP19A1CYP11B1CYP11B2
SCHEMBL11269778 0.87 HMOX1 (0.42) HMOX1
SCHEMBL11265597 0.86 CYP2A6 (0.45) HMOX1CYP2A6CYP19A1CYP11B1CYP11B2
SCHEMBL11256505 0.86 HMOX1 (0.54) HMOX1
SCHEMBL11261576 0.86 CYP2A6 (0.55) HMOX1CYP2A6CYP19A1CYP11B1CYP11B2
SCHEMBL11265306 0.84 CYP2A6 (0.45) 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