SCHEMBL11265820

SCHEMBL11265820

Cc1cc(C)cc(CCC2(Cn3ccnc3)SCC(C)S2)c1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.46
CYP11B2 P19099 3/20 0.46
HMOX1 P09601 3/20 0.39
KMT2A Q03164 1/20 0.38

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
SCHEMBL11259960 0.93 CYP11B1 (0.44) CYP11B1CYP11B2HMOX1KMT2A
SCHEMBL11260781 0.89 HMOX1 (0.46) CYP11B1CYP11B2HMOX1
SCHEMBL11271165 0.88 CYP11B1 (0.48) CYP11B1CYP11B2HMOX1KMT2A
SCHEMBL11253453 0.88 CYP11B1 (0.43) CYP11B1CYP11B2HMOX1KMT2A
SCHEMBL11268891 0.85 CYP11B1 (0.45) CYP11B1CYP11B2HMOX1KMT2A
SCHEMBL11267864 0.85 HMOX1 (0.44) CYP11B1CYP11B2HMOX1
SCHEMBL11273329 0.85 POLB (0.38) CYP11B1CYP11B2HMOX1KMT2A
SCHEMBL11258326 0.84 CYP11B1 (0.51) CYP11B1CYP11B2HMOX1KMT2A
SCHEMBL11261065 0.84 HMOX1 (0.46) HMOX1
SCHEMBL11255804 0.83 HMOX1 (0.56) CYP11B1CYP11B2HMOX1

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