SCHEMBL28432763

SCHEMBL28432763

N=C(N)Nc1cccc(Cl)c1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 4/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ MALT1 Q9UDY8 1/20 0.38
▸ RORC P51449 2/20 0.38
▸ GRIN2D O15399 1/20 0.38
▸ GRIN3B O60391 1/20 0.38
▸ GRIN1 Q05586 1/20 0.38
▸ GRIN2A Q12879 1/20 0.38
▸ GRIN2B Q13224 1/20 0.38
▸ GRIN2C Q14957 1/20 0.38
▸ GRIN3A Q8TCU5 1/20 0.38
▸ CYP1A2 P05177 1/20 0.37
▸ LMNA P02545 3/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ PRSS1 P07477 1/20 0.36
▸ PRSS2 P07478 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
Nitric Acid SCHEMBL7234501 0.81 CYP1A2 (0.50) MAPK1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL11789633 0.78 ALDH1A1 (0.41) MAPK1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL18765136 0.76 TGM2 (0.48) MAPK1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL11155455 0.76 KMT2A (0.48) MAPK1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL28261052 0.75 ARNT (0.43) MAPK1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL27905696 0.75 ALDH1A1 (0.41) MAPK1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL31123135 0.75 ALDH1A1 (0.46) MAPK1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL1848788 0.75 ALDH1A1 (0.46) MAPK1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL10591351 0.74 MEN1 (0.56) MAPK1KMT2AMAPTALDH1A1CYP1A2
SCHEMBL30496751 0.74 CYP1A2 (0.56) MAPK1KMT2AMAPTALDH1A1CYP1A2

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
CN-108468211-B Anti-yellowing agent and preparation method thereof 江苏宇道生物科技有限公司 2020-04-28 — — CN disclosed
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