SCHEMBL8239120

SCHEMBL8239120

CCCCOc1cc(N)ccc1C1CCc2cncn21

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 15/20 0.51
CYP11B1 P15538 3/20 0.46
CYP19A1 P11511 7/20 0.43
CYP17A1 P05093 1/20 0.43
HRH1 P35367 1/20 0.43
KCNH2 Q12809 1/20 0.43

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
SCHEMBL8245759 0.77 CYP11B2 (0.71) CYP11B2CYP11B1CYP19A1KCNH2
SCHEMBL7767391 0.73 CYP11B2 (0.47) CYP11B2CYP11B1CYP19A1CYP17A1HRH1
SCHEMBL22502181 0.69 TSHR (0.49)
SCHEMBL7056177 0.65 GAA (0.59)
SCHEMBL3786692 0.64 GLA (0.53)
SCHEMBL9117478 0.64 GAA (0.53)
SCHEMBL11416116 0.64 CYP1A2 (0.61) KCNH2
SCHEMBL7771681 0.63 CYP19A1 (0.62) CYP11B2CYP11B1CYP19A1KCNH2
SCHEMBL11687770 0.62 KDM4E (0.51)
SCHEMBL11701198 0.62 KDM4E (0.51)

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
WO-2007024945-A1 CONDENSED IMIDAZOLO DERIVATIVES FOR THE INHIBITION OF ALDOSTERONE SYNTHASE AND AROMATASE NOVARTIS AG (CH) 2007-03-01 WO disclosed