SCHEMBL11267485

SCHEMBL11267485

Cc1ccc(CCC2(CCn3ccnc3)SCCC(C)S2)cc1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
HMOX1 P09601 3/20 0.39
QPCT Q16769 1/20 0.39

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
SCHEMBL11253922 0.90 HMOX1 (0.44) CYP19A1CYP11B1CYP11B2HMOX1
SCHEMBL11251457 0.89 CYP19A1 (0.45) CYP19A1CYP11B1CYP11B2HMOX1QPCT
SCHEMBL11268180 0.89 LMNA (0.42) CYP19A1HMOX1
SCHEMBL11252160 0.88 HMOX1 (0.47) CYP19A1HMOX1
SCHEMBL11270311 0.88 CYP19A1 (0.50) CYP19A1CYP11B1CYP11B2HMOX1QPCT
SCHEMBL11266681 0.85 CYP19A1 (0.48) CYP19A1CYP11B1CYP11B2HMOX1QPCT
SCHEMBL11255945 0.84 QPCT (0.43) CYP19A1CYP11B1CYP11B2HMOX1QPCT
SCHEMBL11267659 0.84 CYP19A1 (0.46) CYP19A1CYP11B1CYP11B2HMOX1QPCT
SCHEMBL11267271 0.82 CYP19A1 (0.42) CYP19A1CYP11B1CYP11B2HMOX1QPCT
SCHEMBL10785631 0.82 TBXAS1 (0.40) CYP19A1CYP11B1CYP11B2QPCT

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