SCHEMBL6637992

SCHEMBL6637992

CCOC(=O)COc1ncccc1Oc1cc(NC(C)=O)c(F)cc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
ALDH1A1 P00352 6/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 2/20 0.41
HPGD P15428 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
GALR2 O43603 1/20 0.41
MITF O75030 1/20 0.41
POLB P06746 1/20 0.41
HSP90AA1 P07900 1/20 0.41
XBP1 P17861 1/20 0.41
CCR6 P51684 1/20 0.41
P2RY1 P47900 1/20 0.39
MAPT P10636 5/20 0.39
RAB9A P51151 4/20 0.39
USP2 O75604 1/20 0.38
GAA P10253 2/20 0.38
NPC1 O15118 2/20 0.37
MAPK1 P28482 2/20 0.37

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
SCHEMBL3244558 0.92 MEN1 (0.49) KMT2AMEN1ALDH1A1LMNAPOLB
SCHEMBL6636160 0.86 KMT2A (0.44) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL6637969 0.85 P2RY1 (0.41) KMT2AALDH1A1LMNAPOLBP2RY1
SCHEMBL6640929 0.85 P2RY1 (0.41) LMNAP2RY1MAPTRAB9AUSP2
SCHEMBL5592815 0.83 ALDH1A1 (0.46) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL6639108 0.81 MEN1 (0.46) KMT2AMEN1ALDH1A1LMNANPSR1
SCHEMBL5592875 0.81 MAPT (0.43) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL5551318 0.80 MEN1 (0.39) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL13397203 0.80 ALDH1A1 (0.46) KMT2AMEN1ALDH1A1SMN1; SMN2POLB
SCHEMBL21086831 0.79 P2RY1 (0.43) LMNAPOLBP2RY1MAPT

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