SCHEMBL11233199

SCHEMBL11233199

Cc1cc(C)c(CC2(CCn3ccnc3)OCCO2)c(C)c1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.52
CYP11B2 P19099 2/20 0.52
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HMOX1 P09601 2/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL11231027 0.95 CYP11B1 (0.50) CYP11B1CYP11B2KMT2AMEN1KDM4E
SCHEMBL11241708 0.89 CYP11B1 (0.49) CYP11B1CYP11B2KMT2AMEN1KDM4E
SCHEMBL11239249 0.88 HMOX1 (0.41) CYP11B1CYP11B2KMT2AKDM4EALDH1A1
SCHEMBL11252441 0.87 CYP11B1 (0.47) CYP11B1CYP11B2KMT2AMEN1KDM4E
SCHEMBL11238324 0.87 CYP11B1 (0.55) CYP11B1CYP11B2KMT2AMEN1KDM4E
SCHEMBL11248376 0.86 CYP11B1 (0.46) CYP11B1CYP11B2KMT2AMEN1KDM4E
SCHEMBL11242752 0.86 CYP11B1 (0.51) CYP11B1CYP11B2KMT2AMEN1KDM4E
SCHEMBL11243887 0.86 CYP11B1 (0.49) CYP11B1CYP11B2KMT2AHMOX1
SCHEMBL11243716 0.84 POLB (0.44) CYP11B1CYP11B2KMT2AHMOX1POLB
SCHEMBL11233927 0.84 HMOX1 (0.49) CYP11B1CYP11B2KMT2AMEN1KDM4E

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