SCHEMBL11233475

SCHEMBL11233475

Cc1c(C)c(C)c(CC(=O)Cn2ccnc2)c(C)c1C

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.57
CYP11B2 P19099 1/20 0.57
ALDH1A1 P00352 1/20 0.51
HMOX2 P30519 1/20 0.49
CYP19A1 P11511 1/20 0.44
ALPI P09923 1/20 0.42
ALPG P10696 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PLAA Q9Y263 1/20 0.42
L3MBTL1 Q9Y468 1/20 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
SCHEMBL11238564 0.89 ALDH1A1 (0.47) CYP11B1CYP11B2ALDH1A1HMOX2CYP19A1
SCHEMBL11246282 0.84 EGLN3 (0.54) CYP11B1CYP11B2ALDH1A1
SCHEMBL11238995 0.84 CYP11B1 (0.54) CYP11B1CYP11B2ALDH1A1HMOX2CYP19A1
SCHEMBL11245838 0.83 CYP11B1 (0.60) CYP11B1CYP11B2ALDH1A1HMOX2
SCHEMBL7241523 0.78 ALDH1A1 (0.72) ALDH1A1HMOX2CYP19A1ALPIALPG
SCHEMBL11237322 0.78 CYP11B1 (0.59) CYP11B1CYP11B2ALDH1A1HMOX2CYP19A1
SCHEMBL11248355 0.78 CYP19A1 (0.59) CYP11B1CYP11B2ALDH1A1HMOX2CYP19A1
SCHEMBL11370807 0.77 ALDH1A1 (0.55) CYP11B1CYP11B2ALDH1A1CYP19A1ALPI
SCHEMBL4288375 0.75 ALDH1A1 (0.62) ALDH1A1HMOX2CYP19A1
SCHEMBL11250406 0.75 EGLN3 (0.50) CYP11B1CYP11B2ALDH1A1CYP19A1

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