SCHEMBL30107071

SCHEMBL30107071

CCS(=O)(=O)c1cncc(C=O)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 2/20 0.36
NAMPT P43490 1/20 0.33
GAA P10253 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
PLK4 O00444 1/20 0.32
AURKA O14965 1/20 0.32
ROCK2 O75116 1/20 0.32
CHEK2 O96017 1/20 0.32
PIM1 P11309 1/20 0.32
CDK2 P24941 1/20 0.32
FLT4 P35916 1/20 0.32
KDR P35968 1/20 0.32
MAPK8 P45983 1/20 0.32
MAPK9 P45984 1/20 0.32
CSNK1D P48730 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32

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
SCHEMBL28790641 0.89 PSIP1 (0.36) PSIP1NAMPTGAACYP1A2CYP3A4
SCHEMBL5700587 0.81 PIK3CG (0.36) APLNR
SCHEMBL3464427 0.80 PLK4 (0.40) PSIP1NAMPTGAAPLK4AURKA
SCHEMBL15653319 0.80 ALDH1A1 (0.49) GAA
SCHEMBL30107040 0.80 ALDH1A1 (0.35) PSIP1NAMPTGAACYP1A2CYP3A4
SCHEMBL568488 0.79 PLK4 (0.38) PSIP1NAMPTGAAPLK4AURKA
SCHEMBL13368201 0.77 APLNR (0.55) CYP2C19CDK2APLNR
SCHEMBL13358892 0.77 KDR (0.36) NAMPTPLK4AURKAROCK2CHEK2
SCHEMBL15651479 0.76 TNNI3K (0.39) GAACYP3A4APLNR
SCHEMBL25891814 0.75 PSIP1 (0.40) PSIP1NAMPTGAACYP1A2CYP3A4

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
CN-115551857-A Imidazopyrimidinone compounds as pesticides 巴斯夫欧洲公司 2022-12-30 CN disclosed