SCHEMBL11241537

SCHEMBL11241537

CC1COC(CCn2ccnc2)(Cc2ccc(Br)cc2)O1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 5/20 0.57
CYP19A1 P11511 1/20 0.44
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 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
SCHEMBL11242956 0.90 HMOX1 (0.70) HMOX1
SCHEMBL11241840 0.90 HMOX1 (0.58) HMOX1CYP19A1CYP11B1CYP11B2
SCHEMBL11244604 0.87 HMOX1 (0.55) HMOX1
SCHEMBL11240151 0.87 HMOX1 (0.55) HMOX1CYP19A1CYP11B1
SCHEMBL11242305 0.84 HMOX1 (0.67) HMOX1
SCHEMBL11251950 0.84 HMOX1 (0.56) HMOX1CYP19A1CYP11B1CYP11B2
SCHEMBL11241349 0.84 HMOX1 (0.52) HMOX1CYP19A1
SCHEMBL11243031 0.83 HMOX1 (0.53) HMOX1CYP11B1CYP11B2
SCHEMBL11243731 0.83 HMOX1 (0.66) HMOX1CYP19A1CYP11B1CYP11B2
SCHEMBL11250031 0.83 HMOX1 (0.54) HMOX1CYP19A1CYP11B1CYP11B2

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