SCHEMBL9821141

SCHEMBL9821141

Cc1cnc(-c2ccccc2)nc1-c1cccc(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.49
PTGS1 P23219 1/20 0.48
PTGS2 P35354 1/20 0.48
LMNA P02545 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ADORA1 P30542 4/20 0.47
ADORA2A P29274 3/20 0.47
IDO1 P14902 1/20 0.47
MEN1 O00255 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
KMT2A Q03164 1/20 0.45
AXL P30530 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
ABCB1 P08183 1/20 0.44
ABCC1 P33527 1/20 0.44

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
SCHEMBL10205907 0.84 KMT2A (0.53) L3MBTL1LMNANPSR1MEN1MAPT
SCHEMBL16482024 0.83 AXL (0.47) L3MBTL1PTGS1PTGS2ADORA1ADORA2A
SCHEMBL12813257 0.83 AXL (0.47) PTGS1PTGS2ADORA1ADORA2AIDO1
SCHEMBL9617405 0.81 AXL (0.39) DPP4PTGS1PTGS2LMNANPSR1
SCHEMBL8946347 0.78 MEN1 (0.64) DPP4L3MBTL1LMNANPSR1MEN1
SCHEMBL9717383 0.77 ADORA3 (0.45) DPP4L3MBTL1LMNANPSR1ADORA1
SCHEMBL13841426 0.75 LMNA (0.55) L3MBTL1LMNANPSR1MEN1MAPT
SCHEMBL27976298 0.74 ADORA2A (0.67) DPP4PTGS1PTGS2NPSR1ADORA1
SCHEMBL29620540 0.74 NR1I3 (0.48) DPP4ADORA1ADORA2AIDO1MEN1
SCHEMBL8777123 0.73 PDE10A (0.44) DPP4PTGS1PTGS2CYP1A2ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3148264-A None JP disclosed
JP-H03148264-A 5-ALKYL-2,4-DIPHENYLPYRMIDINE DERIVATIVE, PRODUCTION THEREOF AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT SUMITOMO CHEM CO LTD 1991-06-25 JP disclosed