SCHEMBL6790845

SCHEMBL6790845

Cc1ccc(NC(=O)O[N])cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.57
POLB P06746 1/20 0.55
NPC1 O15118 5/20 0.53
RAB9A P51151 5/20 0.53
SMN1; SMN2 Q16637 4/20 0.51
MAPT P10636 3/20 0.50
ALDH1A1 P00352 2/20 0.50
KIF11 P52732 1/20 0.50
TGM2 P21980 1/20 0.50
KDM4E B2RXH2 1/20 0.50
PTPN7 P35236 1/20 0.49
LMNA P02545 1/20 0.47
RECQL P46063 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL514571 0.83 SMN1; SMN2 (0.69) TDP1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL514570 0.79 TDP1 (0.57) TDP1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL10192033 0.78 ALDH1A1 (0.61) TDP1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL1719720 0.78 SMN1; SMN2 (0.71) TDP1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL178373 0.76 CYP17A1 (0.54) TDP1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL28497934 0.76 TDP1 (0.53) TDP1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL514893 0.76 TDP1 (0.53) TDP1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL10192163 0.76 NPC1 (0.69) TDP1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL30721815 0.76 TDP1 (0.53) TDP1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL27618186 0.76 KIF11 (0.56) TDP1POLBNPC1RAB9ASMN1; SMN2

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
US-6713629-B2 PLANT FUNGICIDE NIPPON SODA CO., LTD. (JP) 2004-03-30 US disclosed