SCHEMBL11247711

SCHEMBL11247711

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

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.42
HMOX1 P09601 4/20 0.42

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
SCHEMBL11235741 0.90 HMOX1 (0.52) TBXAS1HMOX1
SCHEMBL11242048 0.89 TBXAS1 (0.41) TBXAS1HMOX1
SCHEMBL11238404 0.88 HMOX1 (0.47) TBXAS1HMOX1
SCHEMBL11234779 0.88 CYP19A1 (0.46) TBXAS1HMOX1
SCHEMBL11237896 0.88 HMOX1 (0.41) TBXAS1HMOX1
SCHEMBL11238076 0.84 CYP19A1 (0.50) HMOX1
SCHEMBL11250344 0.83 HMOX1 (0.56) HMOX1
SCHEMBL11237614 0.83 CYP1A2 (0.47) TBXAS1HMOX1
SCHEMBL11242641 0.82 HMOX1 (0.59) HMOX1
SCHEMBL11247333 0.81 HMOX1 (0.44) 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