SCHEMBL24844827

SCHEMBL24844827

COC(=O)C1CC1c1ccc(Cn2ccnc2)cn1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 3/20 0.60
CYP11B1 P15538 15/20 0.50
CYP11B2 P19099 10/20 0.47
CYP19A1 P11511 1/20 0.46

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
SCHEMBL24845255 0.86 CYP11B1 (0.52) TBXAS1CYP11B1CYP11B2CYP19A1
SCHEMBL24844760 0.86 CYP11B1 (0.52) TBXAS1CYP11B1CYP11B2CYP19A1
SCHEMBL24844772 0.86 CYP11B1 (0.52) TBXAS1CYP11B1CYP11B2CYP19A1
SCHEMBL24845027 0.84 TBXAS1 (0.64) TBXAS1CYP11B1CYP11B2CYP19A1
SCHEMBL24844769 0.79 FFAR1 (0.40) TBXAS1
SCHEMBL24844825 0.78 TBXAS1 (0.60) TBXAS1CYP11B1CYP11B2CYP19A1
SCHEMBL24844770 0.78 TBXAS1 (0.37) TBXAS1
SCHEMBL24844799 0.76 CYP11B1 (0.47) TBXAS1CYP11B1CYP11B2CYP19A1
SCHEMBL20198842 0.72 PDE10A (0.45) TBXAS1
SCHEMBL20198855 0.72 PDE10A (0.45) TBXAS1

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-2023274257-A1 IMIDAZOLE COMPOUND, AND INTERMEDIATE AND APPLICATION THEREOF 诸葛国琴 2023-01-05 WO disclosed