SCHEMBL7905475

SCHEMBL7905475

COC(=O)c1cc(-n2c(=O)cc(C(F)(F)F)n3ccnc23)ccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
MAPT P10636 4/20 0.40
ALDH1A1 P00352 2/20 0.40
HTT P42858 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NOTUM Q6P988 4/20 0.39
ADORA3 P0DMS8 2/20 0.35
LMNA P02545 4/20 0.35
GAA P10253 1/20 0.35
CTSB P07858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
POLB P06746 1/20 0.33
MYC P01106 1/20 0.33

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
SCHEMBL7901370 0.89 CYP4F2 (0.39) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL7901519 0.83 GAA (0.33) KMT2AMAPTALDH1A1HPGDHSD17B10
SCHEMBL6697536 0.79 MEN1 (0.44) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL7901403 0.78 MCL1 (0.41)
SCHEMBL8129422 0.74 NOTUM (0.39) KMT2AMAPTALDH1A1NPSR1TP53
SCHEMBL7901344 0.73 BAZ2B (0.39) ALDH1A1HPGDHSD17B10GAAMRGPRX4
SCHEMBL8388909 0.72 NOTUM (0.31) NOTUM
SCHEMBL7894182 0.71 LMNA (0.41) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL7903043 0.70 GAA (0.32) GAA
SCHEMBL6553913 0.69 MEN1 (0.35) MEN1KMT2AMAPTALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6191070-B1 Pyrimidinone derivatives and herbicides containing them SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-02-20 US claimed
US-6191070-B1 Pyrimidinone derivatives and herbicides containing them SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-02-20 US disclosed
US-6165942-A Heterocycle-fused pyrimidinone derivative and herbicidal composition NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2000-12-26 US disclosed
EP-0970958-A1 HETEROCYCLE-FUSED PYRIMIDINONE DERIVATIVES AND HERBICIDES NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 2000-01-12 EP disclosed
EP-0902029-A1 Pyrimidinone derivatives and herbicides containing them SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-03-17 EP disclosed