SCHEMBL6638772

SCHEMBL6638772

COC(=O)C(C)Oc1ncccc1Oc1cc(NC(C)=O)c(F)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
P2RY1 P47900 5/20 0.41
DHODH Q02127 2/20 0.41
MAPT P10636 2/20 0.40
ALDH1A1 P00352 1/20 0.40
ATM Q13315 1/20 0.39
MAPK8 P45983 1/20 0.38
RORC P51449 2/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SCN9A Q15858 1/20 0.36
CARM1 Q86X55 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
NPSR1 Q6W5P4 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
SCHEMBL6642262 0.92 P2RY1 (0.40) P2RY1DHODHMAPTALDH1A1MAPK8
SCHEMBL6640646 0.89 P2RY1 (0.41) P2RY1DHODHMAPTATMMEN1
SCHEMBL6639108 0.85 MEN1 (0.46) P2RY1MAPTALDH1A1ATMMEN1
SCHEMBL6639629 0.85 MAPK8 (0.40) P2RY1MAPTMAPK8MEN1KMT2A
SCHEMBL3955026 0.82 ATM (0.42) P2RY1MAPTALDH1A1ATMMAPK8
SCHEMBL6639707 0.81 MAPT (0.37) P2RY1MAPTMAPK8MEN1KMT2A
SCHEMBL6637735 0.80 P2RY1 (0.40) P2RY1DHODHMAPTATML3MBTL1
SCHEMBL6637969 0.80 P2RY1 (0.41) P2RY1MAPTALDH1A1ATMMAPK8
SCHEMBL14639527 0.80 P2RY1 (0.43) P2RY1DHODHMAPTALDH1A1ATM
SCHEMBL6666269 0.79 MAPT (0.38) P2RY1MAPTALDH1A1MAPK8RORC

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
EP-1122244-B1 Uracil compounds and their use SUMITOMO CHEMICAL CO (JP) 2004-09-29 EP disclosed
US-6537948-B1 Have a wide range of herbicidal spectrum, and causes no phytotoxicity on crops SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-25 US disclosed
EP-1122244-A1 Uracil compounds and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-08-08 EP disclosed