SCHEMBL30050008

SCHEMBL30050008

O=C(O)c1n[nH]c2cc(F)cc(F)c12

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 7/20 0.44
GPR17 Q13304 1/20 0.42
PRKAG1 P54619 4/20 0.40
PRKAA1 Q13131 4/20 0.40
PRKAB1 Q9Y478 4/20 0.40
PRKAB2 O43741 3/20 0.40
PRKAA2 P54646 3/20 0.40
PRKAG3 Q9UGI9 3/20 0.40
PRKAG2 Q9UGJ0 3/20 0.40
MAP2K4 P45985 2/20 0.40
MAPK1 P28482 1/20 0.40
MAPK6 Q16659 1/20 0.40
HAO2 Q9NYQ3 1/20 0.37
EGLN1 Q9GZT9 1/20 0.35
CA12 O43570 1/20 0.35
ALPL P05186 1/20 0.35
RPA1 P27694 1/20 0.35

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
SCHEMBL23858844 1.00 HCAR2 (0.44) HCAR2GPR17PRKAG1PRKAA1PRKAB1
SCHEMBL29324357 0.85 GPR17 (0.35) HCAR2GPR17PRKAG1PRKAA1PRKAB1
SCHEMBL28496732 0.83 GPR17 (0.45) HCAR2GPR17PRKAG1PRKAA1PRKAB1
SCHEMBL23872474 0.81 KDM4E (0.48) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2
SCHEMBL16240884 0.76 CTNNB1 (0.44) HCAR2PRKAG1PRKAA1PRKAB1PRKAB2
SCHEMBL4785188 0.75 PRKAG1 (0.58) HCAR2PRKAG1PRKAA1PRKAB1PRKAB2
SCHEMBL2955386 0.74 MAP2K4 (0.37) GPR17MAP2K4MAPK1MAPK6CA12
SCHEMBL2816583 0.72 MAP2K4 (0.61) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2
SCHEMBL16517070 0.72 PRKAB2 (0.34) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2
SCHEMBL5522246 0.71 PRKAG1 (0.40) PRKAG1PRKAA1PRKAB1PRKAB2PRKAA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115335378-B Monoacylglycerol lipase modulators 詹森药业有限公司 2025-03-04 CN disclosed
EP-4126860-A1 MONOACYLGLYCEROL LIPASE MODULATORS Janssen Pharmaceutica NV (BE) 2023-02-08 EP disclosed
CN-115335378-A Monoacylglycerol lipase modulators 詹森药业有限公司 2022-11-11 CN disclosed