SCHEMBL11238697

SCHEMBL11238697

CCCC1(CCC)COC(CCc2c(C)cc(C)cc2C)(Cn2ccnc2)OC1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
HMOX1 P09601 4/20 0.44

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
SCHEMBL11241813 0.92 CYP11B1 (0.47) CYP11B1CYP11B2HMOX1
SCHEMBL11237586 0.90 HMOX1 (0.50) CYP11B1CYP11B2HMOX1
SCHEMBL11237327 0.90 CYP11B1 (0.47) CYP11B1CYP11B2HMOX1
SCHEMBL11238926 0.89 HMOX1 (0.44) HMOX1
SCHEMBL11241521 0.88 HMOX1 (0.46) CYP11B1CYP11B2HMOX1
SCHEMBL11229057 0.88 CYP11B1 (0.49) CYP11B1CYP11B2HMOX1
SCHEMBL11237414 0.86 HMOX1 (0.44) HMOX1
SCHEMBL11240829 0.86 HMOX1 (0.58) CYP11B1CYP11B2HMOX1
SCHEMBL11237003 0.84 HMOX1 (0.53) CYP11B1CYP11B2HMOX1
SCHEMBL11245640 0.84 HMOX1 (0.46) HMOX1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0049565-A2 Derivatives of substituted N-alkylimidazoles, their preparation and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1982-04-14 EP disclosed
US-4321272-A Derivatives of substituted N-alkylimidazoles SYNTEX (U.S.A.) INC. (US) 1982-03-23 US disclosed