SCHEMBL8559170

SCHEMBL8559170

N#Cc1ccnc([N+](=O)[O-])c1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 1/20 0.41
▸ DPP4 P27487 1/20 0.38
▸ MAPT P10636 5/20 0.37
▸ ALDH1A1 P00352 5/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ VCAM1 P19320 3/20 0.37
▸ GRIA1 P42261 2/20 0.35
▸ GRIA2 P42262 2/20 0.35
▸ GRIA3 P42263 2/20 0.35
▸ GRIA4 P48058 2/20 0.35
▸ GRM6 O15303 1/20 0.35
▸ HPGD P15428 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ APEX1 P27695 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL5319082 0.79 VCAM1 (0.44) DPP4MAPTALDH1A1MEN1KMT2A
SCHEMBL8569914 0.76 MAPT (0.42) XDHMAPTALDH1A1MEN1KMT2A
SCHEMBL8141010 0.76 HTT (0.37) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL126342 0.75 ALDH1A1 (0.44) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL8564386 0.74 ALDH1A1 (0.41) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL3709618 0.73 GAA (0.39) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL3218043 0.73 NOS3 (0.50) MAPTALDH1A1MEN1KMT2ARECQL
SCHEMBL8567050 0.73 ROCK1 (0.34) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL18474451 0.73 ALDH1A1 (0.39) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL8565961 0.72 CA2 (0.39) MAPTALDH1A1VCAM1CYP2C9APEX1

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
EP-0735025-B1 Process for producing aminonitropyridines SUMITOMO CHEMICAL CO (JP) 1998-07-01 — — EP disclosed
US-5648496-A AMINATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-15 — — US disclosed
EP-0735025-A1 Process for producing aminonitropyridines SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-10-02 — — EP disclosed
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