SCHEMBL11250344

SCHEMBL11250344

CC1(C)COC(Cc2ccc(Cl)cc2)(Cn2ccnc2)OC1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 2/20 0.56
CYP2A6 P11509 1/20 0.50
CYP19A1 P11511 1/20 0.50
CYP11B1 P15538 1/20 0.50
CYP11B2 P19099 1/20 0.50
CYP2B6 P20813 1/20 0.50

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
Oxalic Acid SCHEMBL11234093 0.93 HMOX1 (0.51) HMOX1
SCHEMBL11238076 0.89 CYP19A1 (0.50) HMOX1CYP19A1CYP11B1CYP11B2
SCHEMBL11246847 0.88 HMOX1 (0.54) HMOX1CYP2A6CYP19A1CYP11B1CYP11B2
SCHEMBL11251358 0.88 HMOX1 (0.69) HMOX1
SCHEMBL11247333 0.88 HMOX1 (0.44) HMOX1
SCHEMBL11239810 0.88 HMOX1 (0.49) HMOX1CYP2A6CYP19A1CYP11B1CYP11B2
SCHEMBL11237614 0.88 CYP1A2 (0.47) HMOX1CYP19A1CYP11B1CYP11B2
SCHEMBL11256745 0.87 HMOX1 (0.58) HMOX1CYP2A6CYP19A1CYP11B1CYP11B2
Hydrochloric Acid SCHEMBL11245515 0.87 HMOX1 (0.70) HMOX1
SCHEMBL11236793 0.86 HMOX1 (0.55) 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 1 patent. 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