SCHEMBL11246282

SCHEMBL11246282

Cc1c(C)c(C)c(CC(=O)CCn2ccnc2)c(C)c1C

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGLN3 Q9H6Z9 1/20 0.54
CYP11B1 P15538 1/20 0.54
CYP11B2 P19099 1/20 0.54
TBXAS1 P24557 12/20 0.45
PRKCI P41743 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL11250406 0.90 EGLN3 (0.50) EGLN3CYP11B1CYP11B2TBXAS1MEN1
SCHEMBL11233475 0.84 CYP11B1 (0.57) CYP11B1CYP11B2ALDH1A1
SCHEMBL11241105 0.84 CYP11B1 (0.57) EGLN3CYP11B1CYP11B2TBXAS1MEN1
SCHEMBL11236348 0.79 CYP19A1 (0.56) EGLN3CYP11B1CYP11B2TBXAS1ALDH1A1
SCHEMBL11244197 0.79 CYP11B1 (0.56) EGLN3CYP11B1CYP11B2TBXAS1MEN1
SCHEMBL11253132 0.78 EGLN3 (0.50) EGLN3TBXAS1MEN1KMT2A
SCHEMBL11256842 0.78 EGLN3 (0.50) EGLN3TBXAS1MEN1KMT2AALDH1A1
SCHEMBL11264399 0.77 CYP11B1 (0.58) EGLN3CYP11B1CYP11B2TBXAS1MEN1
SCHEMBL10780853 0.77 EGLN3 (0.65) EGLN3TBXAS1ALDH1A1
SCHEMBL47382 0.77 EGLN3 (0.69) EGLN3TBXAS1ALDH1A1

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