SCHEMBL9524112

SCHEMBL9524112

N#Cc1cc(C2CCCc3cncn32)cc2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 15/20 0.59
CYP11B2 P19099 9/20 0.59
CYP11B1 P15538 4/20 0.59
KCNH2 Q12809 1/20 0.59

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
SCHEMBL9524269 0.79 CYP19A1 (0.49) CYP19A1CYP11B2CYP11B1KCNH2
SCHEMBL2353249 0.78 CYP19A1 (0.63) CYP19A1CYP11B2CYP11B1KCNH2
SCHEMBL9261186 0.77 CYP11B2 (0.63) CYP19A1CYP11B2CYP11B1KCNH2
SCHEMBL13529263 0.76 CYP19A1 (0.66) CYP19A1CYP11B2CYP11B1KCNH2
SCHEMBL13529262 0.76 CYP19A1 (0.66) CYP19A1CYP11B2CYP11B1KCNH2
SCHEMBL9256368 0.75 CYP11B2 (0.73) CYP19A1CYP11B2CYP11B1KCNH2
SCHEMBL14769100 0.75 CYP19A1 (0.73) CYP19A1CYP11B2CYP11B1KCNH2
Fadrozole SCHEMBL25491 0.74 CYP19A1 (1.00) CYP19A1CYP11B2CYP11B1KCNH2
Dexfadrostat SCHEMBL685516 0.74 CYP19A1 (1.00) CYP19A1CYP11B2CYP11B1KCNH2
Fadrozole SCHEMBL3295820 0.74 CYP19A1 (1.00) CYP19A1CYP11B2CYP11B1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0356673-B1 Substituted 5,6,7,8-tetrahydroimidazo[1,5-a]pyridines and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1993-05-19 EP disclosed