SCHEMBL9869630

SCHEMBL9869630

Cc1ccc(N[N+](=O)[O-])nn1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.36
GAA P10253 2/20 0.36
KDM4E B2RXH2 1/20 0.36
SORT1 Q99523 1/20 0.35
EDNRA P25101 1/20 0.33
ALDH1A1 P00352 2/20 0.32
APLNR P35414 1/20 0.31
CYP1A2 P05177 1/20 0.31
ACHE P22303 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CTSB P07858 1/20 0.30
CTSH P09668 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL9870304 0.76 MAPT (0.50) MAPTGAAKDM4EEDNRAALDH1A1
SCHEMBL9200339 0.71 RAB9A (0.52) KDM4ESORT1ALDH1A1CYP1A2HSD17B10
SCHEMBL14596452 0.68 ALDH1A1 (0.42) MAPTGAAKDM4EALDH1A1APLNR
SCHEMBL9869877 0.68 GOT1 (0.50) MAPTGAAKDM4EALDH1A1
SCHEMBL3584566 0.67
SCHEMBL12607338 0.67 KDM4E (0.38) MAPTGAAKDM4ESORT1EDNRA
SCHEMBL7386169 0.67 NOS3 (0.53) MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL31153189 0.67 ABCG2 (0.38) MAPTGAAALDH1A1CYP1A2SMN1; SMN2
SCHEMBL310954 0.66
SCHEMBL7098220 0.65 ALDH1A1 (0.50) MAPTGAAKDM4EALDH1A1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4988712-A INSECTICIDES NIHON TOKUSHU NOYAKU SEIZO, K.K. (JP) 1991-01-29 US disclosed
US-4882344-A INSECTICIDES NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1989-11-21 US disclosed
US-4803277-A INSECTICIDES NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1989-02-07 US disclosed