SCHEMBL27713666

SCHEMBL27713666

CC(C)C(C(=O)Nc1ncc([N+](=O)[O-])s1)c1ccc(Cl)cc1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FFAR2 O15552 15/20 0.71
▸ STAT3 P40763 1/20 0.62
▸ MEN1 O00255 3/20 0.58
▸ LMNA P02545 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ MAPT P10636 2/20 0.58
▸ HTT P42858 2/20 0.58
▸ RAB9A P51151 2/20 0.58
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ ALDH1A1 P00352 1/20 0.58
▸ ATG4B Q9Y4P1 1/20 0.56
▸ NPC1 O15118 1/20 0.56
▸ NPY1R P25929 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
SCHEMBL16369612 0.81 FFAR2 (1.00) FFAR2MEN1LMNAKMT2A
SCHEMBL16369613 0.81 FFAR2 (1.00) FFAR2MEN1LMNAKMT2A
SCHEMBL2021216 0.79 FFAR2 (0.80) FFAR2MEN1LMNAKMT2A
SCHEMBL2681128 0.77 STAT3 (1.00) STAT3MEN1LMNAKMT2AMAPT
SCHEMBL1394820 0.77 ATG4B (0.58) STAT3MEN1LMNAKMT2AMAPT
SCHEMBL10707979 0.73 FFAR2 (0.64) FFAR2MEN1KMT2AMAPTHTT
SCHEMBL16369642 0.73 FFAR2 (1.00) FFAR2MEN1LMNAKMT2A
SCHEMBL16369644 0.73 FFAR2 (1.00) FFAR2MEN1LMNAKMT2A
SCHEMBL2753331 0.73 MEN1 (0.72) FFAR2MEN1LMNAKMT2AMAPT
SCHEMBL18529257 0.72 ATG4B (1.00) STAT3MEN1LMNAKMT2AMAPT

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-101230050-A Thiazole chrysanthemum acidamide compounds and uses thereof UNIV ZHEJIANG (CN) 2008-07-30 — — CN disclosed
Send feedback