SCHEMBL8926511

SCHEMBL8926511

C/C(=N\[N+](=O)[O-])N(C)Cc1ccc(Cl)nc1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
CHRNB2 P17787 3/20 0.41
CHRNA4 P43681 3/20 0.41
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ATM Q13315 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
CASP6 P55212 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL2755020 1.00 ALDH1A1 (0.43) ALDH1A1CHRNB2CHRNA4MEN1KMT2A
SCHEMBL8866534 0.86 CHRNB2 (0.39) ALDH1A1CHRNB2CHRNA4MEN1KMT2A
SCHEMBL8866545 0.86 CHRNB2 (0.39) ALDH1A1CHRNB2CHRNA4MEN1KMT2A
SCHEMBL7638479 0.86 CHRNB2 (0.43) ALDH1A1CHRNB2CHRNA4MEN1KMT2A
SCHEMBL7643543 0.86 CHRNB2 (0.40) ALDH1A1CHRNB2CHRNA4MEN1KMT2A
SCHEMBL7638475 0.86 CHRNB2 (0.43) ALDH1A1CHRNB2CHRNA4MEN1KMT2A
SCHEMBL7643537 0.86 CHRNB2 (0.40) ALDH1A1CHRNB2CHRNA4MEN1KMT2A
SCHEMBL9501179 0.86 ALDH1A1 (0.38) ALDH1A1CHRNB2CHRNA4MEN1KMT2A
SCHEMBL7637289 0.84 CHRNB2 (0.39) ALDH1A1CHRNB2CHRNA4MEN1KMT2A
SCHEMBL7637297 0.84 CHRNB2 (0.39) ALDH1A1CHRNB2CHRNA4MEN1KMT2A

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-5304566-A Pyridine compounds which have useful insecticidal utility NIPPON SODA CO., LTD (JP) 1994-04-19 US claimed
US-5612358-A Pyridine compouds which have useful insecticidal activity NIPPON SODA CO., LTD. (JP) 1997-03-18 US disclosed
US-5304566-A Pyridine compounds which have useful insecticidal utility NIPPON SODA CO., LTD (JP) 1994-04-19 US disclosed
EP-0456826-A1 AMINE DERIVATIVES NIPPON SODA CO., LTD. (JP) 1991-11-21 EP disclosed
WO-1991004965-A1 AMINE DERIVATIVES NIPPON SODA CO., LTD. (JP) 1991-04-18 WO disclosed