SCHEMBL7374472

SCHEMBL7374472

CC(=O)C(=Cc1ccccc1[N+](=O)[O-])C(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.60
NPSR1 Q6W5P4 1/20 0.60
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
GLO1 Q04760 1/20 0.47
PKM P14618 1/20 0.46
GPR55 Q9Y2T6 1/20 0.46
ALDH1A1 P00352 5/20 0.44
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL7374470 1.00 MAPT (0.60) MAPTNPSR1NPC1RAB9AMEN1
SCHEMBL11013041 0.90 MAPT (0.54) MAPTNPSR1NPC1RAB9AMEN1
SCHEMBL11013042 0.90 MAPT (0.54) MAPTNPSR1NPC1RAB9AMEN1
SCHEMBL10386660 0.86 MAPT (0.64) MAPTNPSR1RAB9AMEN1KMT2A
SCHEMBL30553800 0.86 MAPT (0.64) MAPTNPSR1RAB9AMEN1KMT2A
SCHEMBL7270940 0.86 MAPT (0.64) MAPTNPSR1RAB9AMEN1KMT2A
SCHEMBL29043783 0.86 MAPT (0.64) MAPTNPSR1RAB9AMEN1KMT2A
SCHEMBL4608555 0.83 MAPT (0.60) MAPTNPSR1NPC1RAB9AMEN1
SCHEMBL4608422 0.83 MAPT (0.60) MAPTNPSR1NPC1RAB9AMEN1
SCHEMBL7271101 0.83 MAPT (0.64) MAPTNPSR1MEN1KMT2AGLO1

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-4525478-A Certain 4-aryl-1,4-dihydro-3,5-pyridinedicarboxylates having vasodilating and anti-hypertensive properties FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-06-25 US disclosed
US-4370334-A VASODILATION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-01-25 US disclosed
US-4338322-A 1,4-Dihydropyridine derivatives, pharmaceutical compositions containing same and methods of effecting vasodilation using same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-07-06 US disclosed
US-4284634-A HYPOTENSIVE VASODILATORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-08-18 US disclosed
US-4145432-A 6-ACYLORYALKYL-1,4-DIHYDROPYRIDINE DERIVATIVES AND A METHOD OF EFFECTING VASODILATION THEREWITH FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1979-03-20 US disclosed