SCHEMBL28092071

SCHEMBL28092071

Cc1c(Cl)cccc1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.67
▸ LMNA P02545 4/20 0.67
▸ ALDH1A1 P00352 2/20 0.65
▸ HTT P42858 1/20 0.65
▸ L3MBTL1 Q9Y468 2/20 0.61
▸ NPY1R P25929 1/20 0.61
▸ MC4R P32245 1/20 0.61
▸ NPY2R P49146 1/20 0.61
▸ PKM P14618 1/20 0.59
▸ MEN1 O00255 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ POLB P06746 1/20 0.57
▸ NPSR1 Q6W5P4 2/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ NPC1 O15118 1/20 0.56
▸ GAA P10253 1/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56

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
SCHEMBL8026664 0.81 MAPT (0.67) MAPTLMNAALDH1A1HTTL3MBTL1
SCHEMBL1454743 0.81 MAPT (0.70) MAPTLMNAALDH1A1HTTL3MBTL1
SCHEMBL13401489 0.80 ALDH1A1 (0.72) MAPTLMNAALDH1A1HTTL3MBTL1
SCHEMBL11305819 0.79 MAPT (0.73) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL12316880 0.78 MAPT (0.69) MAPTLMNAALDH1A1HTTKMT2A
SCHEMBL1454119 0.78 KMT2A (0.73) MAPTLMNAALDH1A1HTTPKM
SCHEMBL1455286 0.78 KMT2A (0.90) MAPTLMNAALDH1A1HTTMEN1
SCHEMBL8305318 0.78 MAPT (0.57) MAPTLMNAALDH1A1HTTMEN1
SCHEMBL8303930 0.78 POLB (0.57) MAPTLMNAALDH1A1HTTMEN1
SCHEMBL7161319 0.78 CRHBP (0.77) MAPTLMNAL3MBTL1MEN1KMT2A

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
CN-111269157-B Amisulpride impurity and preparation method thereof 南京海纳医药科技股份有限公司 2021-12-03 — — CN disclosed
CN-111269157-A Amisulpride impurity and preparation method thereof 南京海纳医药科技股份有限公司 2020-06-12 — — CN disclosed
CN-105936625-A Synthesis method of 3-amino-4-chloro-N-(3-chloro-2-methylphenyl)benzamide 常州市阿曼特化工有限公司 2016-09-14 — — CN disclosed
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