SCHEMBL8718072

SCHEMBL8718072

CCCCC(=O)N(OC(=O)CCC)c1ccc(NC(=O)c2cc3cc(C(=N)N)ccc3o2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 5/20 0.45
ITGA2B P08514 5/20 0.45
MAPT P10636 4/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
MAPK1 P28482 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TSHR P16473 1/20 0.44
CASP3 P42574 1/20 0.44
HSD17B10 Q99714 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
F2 P00734 5/20 0.43
PLG P00747 3/20 0.43
PLAU P00749 3/20 0.43
PLAT P00750 3/20 0.43
KLKB1 P03952 3/20 0.43
PRSS1 P07477 3/20 0.43
HRAS P01112 2/20 0.41

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
SCHEMBL8713275 0.83 ITGB3 (0.51) ITGB3ITGA2BMAPTNPC1RAB9A
SCHEMBL8716062 0.82 F2 (0.51) ITGB3ITGA2BMAPTNPC1RAB9A
SCHEMBL8718116 0.75 F2 (0.52) ITGB3ITGA2BMAPTNPC1RAB9A
SCHEMBL8718457 0.75 PLG (0.55) ITGB3ITGA2BMAPTNPC1RAB9A
SCHEMBL8718100 0.74 TPSAB1 (0.66) ITGB3ITGA2BMAPTNPC1RAB9A
SCHEMBL8904666 0.72 ITGB3 (0.62) ITGB3ITGA2BNPC1RAB9AF2
SCHEMBL8718459 0.71 ITGB3 (0.57) ITGB3ITGA2BNPC1RAB9AF2
SCHEMBL8718076 0.71 PLAU (0.41) F2PLGPLAUPLATKLKB1
SCHEMBL8904266 0.70 NPC1 (0.44) ITGB3ITGA2BMAPTNPC1RAB9A
SCHEMBL8717795 0.70 F2 (0.57) ITGB3ITGA2BNPC1RAB9AMEN1

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-5753670-A ANTICOAGULANTS THE GREEN CROSS CORPORATION (JP) 1998-05-19 US disclosed