SCHEMBL24844879

SCHEMBL24844879

O=C(O)C1CC1c1ccc(Cn2ccnc2)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 11/20 0.42
CYP19A1 P11511 5/20 0.42
FFAR1 O14842 1/20 0.40
MC4R P32245 1/20 0.40
CYP1A2 P05177 1/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
QPCT Q16769 1/20 0.39
CYP4Z1 Q86W10 1/20 0.39
QPCTL Q9NXS2 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
SCHEMBL24845158 1.00 TBXAS1 (0.42) TBXAS1CYP19A1FFAR1MC4RCYP1A2
SCHEMBL24844749 1.00 TBXAS1 (0.42) TBXAS1CYP19A1FFAR1MC4RCYP1A2
SCHEMBL24845016 0.86 CYP4F2 (0.46) TBXAS1CYP19A1
SCHEMBL24844867 0.86 CYP4F2 (0.46) TBXAS1CYP19A1
SCHEMBL24844787 0.86 CYP4F2 (0.46) TBXAS1CYP19A1
SCHEMBL24844878 0.86 CYP11B1 (0.47) TBXAS1CYP19A1FFAR1CYP11B1CYP11B2
SCHEMBL24844767 0.86 CYP11B1 (0.47) TBXAS1CYP19A1FFAR1CYP11B1CYP11B2
SCHEMBL24844888 0.86 CYP11B1 (0.47) TBXAS1CYP19A1FFAR1CYP11B1CYP11B2
SCHEMBL24844935 0.85 TBXAS1 (0.46) TBXAS1CYP19A1MC4RCYP11B1CYP11B2
SCHEMBL24844882 0.83 TBXAS1 (0.56) TBXAS1CYP19A1CYP1A2POLBCYP3A4

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