SCHEMBL27999879

SCHEMBL27999879

CCOc1ccc(N)c([N+](=O)[O-])c1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.46
▸ ALDH1A1 P00352 6/20 0.46
▸ LMNA P02545 5/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ MEN1 O00255 3/20 0.43
▸ POLB P06746 3/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ AGPAT2 O15120 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ USP2 O75604 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HTT P42858 3/20 0.39
▸ CREBBP Q92793 1/20 0.39

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
SCHEMBL16174936 0.85 MAPT (0.49) MAPTALDH1A1LMNAKMT2ANPSR1
SCHEMBL27641662 0.84 MAPT (0.46) MAPTALDH1A1LMNAKMT2ANPSR1
SCHEMBL28284559 0.83 MAPT (0.45) MAPTALDH1A1LMNAKMT2ANPSR1
SCHEMBL27689498 0.78 LMNA (0.46) MAPTALDH1A1LMNAKMT2ANPSR1
SCHEMBL30897300 0.78 ALDH1A1 (0.55) MAPTALDH1A1LMNAKMT2ANPSR1
SCHEMBL11193937 0.78 ALDH1A1 (0.55) MAPTALDH1A1LMNAKMT2ANPSR1
SCHEMBL27512449 0.77 MAPT (0.49) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL24022121 0.76 MAPT (0.52) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL700508 0.74 TDP1 (0.68) MAPTALDH1A1LMNAKMT2ANPSR1
SCHEMBL31588036 0.74 ALDH1A1 (0.50) MAPTALDH1A1LMNAKMT2ANPSR1

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-102821838-B Method for producing colorants HENKEL AG & CO KGAA 2015-03-25 — — CN disclosed
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