SCHEMBL11243136

SCHEMBL11243136

Cc1cccc(CC(=O)Cn2ccnc2)c1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.63
CYP11B2 P19099 2/20 0.63
CYP19A1 P11511 2/20 0.49
HMOX2 P30519 1/20 0.49
TBXAS1 P24557 1/20 0.46

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
SCHEMBL11244892 0.87 CYP11B1 (0.60) CYP11B1CYP11B2CYP19A1HMOX2TBXAS1
SCHEMBL11229525 0.87 CYP11B1 (0.60) CYP11B1CYP11B2CYP19A1TBXAS1
SCHEMBL11237322 0.86 CYP11B1 (0.59) CYP11B1CYP11B2CYP19A1HMOX2
SCHEMBL11248755 0.83 CYP19A1 (0.57) CYP11B1CYP11B2CYP19A1
SCHEMBL11248355 0.83 CYP19A1 (0.59) CYP11B1CYP11B2CYP19A1HMOX2TBXAS1
SCHEMBL11238973 0.83 HMOX2 (0.64) CYP11B1CYP11B2CYP19A1HMOX2TBXAS1
SCHEMBL11240992 0.78 HMOX2 (0.46) CYP11B1CYP11B2CYP19A1HMOX2TBXAS1
SCHEMBL12205 0.78 CYP11B1 (1.00) CYP11B1CYP11B2CYP19A1TBXAS1
SCHEMBL5523502 0.78 ALPG (0.62) CYP11B1CYP11B2CYP19A1
Sulfuric Acid SCHEMBL11263269 0.78 HMOX2 (0.58) CYP11B1CYP11B2CYP19A1HMOX2TBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4359475-A SPERMICIDES, MICROBIOCIDES OR ANTICONVULSANTS SYNTEX (U.S.A.) INC. (US) 1982-11-16 US disclosed
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