SCHEMBL11246571

SCHEMBL11246571

Cc1cc(C)c(CC2(Cn3ccnc3)OCC(C)(C)CO2)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.51
CYP11B2 P19099 2/20 0.51
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.38
HMOX1 P09601 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ATM Q13315 1/20 0.37

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
SCHEMBL11238324 0.89 CYP11B1 (0.55) CYP11B1CYP11B2KMT2AMEN1HMOX1
SCHEMBL11241708 0.88 CYP11B1 (0.49) CYP11B1CYP11B2KMT2AMEN1KDM4E
SCHEMBL11229057 0.88 CYP11B1 (0.49) CYP11B1CYP11B2HMOX1
SCHEMBL11230104 0.88 CYP11B1 (0.49) CYP11B1CYP11B2KMT2AMEN1HMOX1
SCHEMBL11249818 0.88 CYP11B1 (0.39) CYP11B1CYP11B2HMOX1
SCHEMBL11233705 0.86 CYP11B1 (0.52) CYP11B1CYP11B2KMT2AMEN1HMOX1
SCHEMBL11239251 0.86 CYP11B1 (0.50) CYP11B1CYP11B2HMOX1
SCHEMBL11237327 0.86 CYP11B1 (0.47) CYP11B1CYP11B2KMT2AHMOX1
SCHEMBL11247213 0.86 CYP11B1 (0.48) CYP11B1CYP11B2HMOX1
SCHEMBL11235854 0.86 CYP11B1 (0.40) CYP11B1CYP11B2HMOX1

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