SCHEMBL11239019

SCHEMBL11239019

Cc1cc(C)c(C)c(CC2(Cn3ccnc3)OCCO2)c1C

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 3/20 0.48
CYP11B1 P15538 3/20 0.41
CYP11B2 P19099 3/20 0.41

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
SCHEMBL11238681 0.95 HMOX1 (0.44) HMOX1CYP11B1CYP11B2
SCHEMBL11252757 0.91 CYP11B1 (0.51) HMOX1CYP11B1CYP11B2
SCHEMBL11249818 0.89 CYP11B1 (0.39) HMOX1CYP11B1CYP11B2
SCHEMBL11239249 0.87 HMOX1 (0.41) HMOX1CYP11B1CYP11B2
SCHEMBL11246026 0.87 HMOX1 (0.58) HMOX1
SCHEMBL11238324 0.87 CYP11B1 (0.55) HMOX1CYP11B1CYP11B2
SCHEMBL11240041 0.87 CYP11B1 (0.37) HMOX1CYP11B1CYP11B2
SCHEMBL11243127 0.85 CYP11B1 (0.49) HMOX1CYP11B1CYP11B2
SCHEMBL11246392 0.85 HMOX1 (0.38) HMOX1CYP11B1CYP11B2
SCHEMBL11233061 0.83 HMOX1 (0.56) 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