SCHEMBL9570485

SCHEMBL9570485

O=c1[nH]c(=O)n(CCc2cccs2)c(=O)[nH]1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.48
CNOT7 Q9UIV1 1/20 0.46
HCAR2 Q8TDS4 2/20 0.45
PIK3CD O00329 1/20 0.43
PIK3CA P42336 1/20 0.43
PIK3CB P42338 1/20 0.43
PIK3CG P48736 1/20 0.43
GAA P10253 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
HRH3 Q9Y5N1 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPT P10636 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
PDE2A O00408 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
SCHEMBL8799962 0.80 TAAR1 (0.50) CNOT7GAATAAR1HRH3MEN1
SCHEMBL5426939 0.75 PDE2A (0.46) CNOT7MEN1KMT2AHSD17B10ALDH1A1
SCHEMBL2774914 0.73 ALDH1A1 (0.47) CNOT7PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL28562224 0.73 KMT2A (0.60) GAAMEN1KMT2AMAPTHSD17B10
SCHEMBL21493552 0.71 CNOT7 (0.53) GPR84CNOT7TAAR1HRH3MAPT
SCHEMBL14678488 0.70 MGLL (0.52) CNOT7TAAR1HRH3MEN1KMT2A
SCHEMBL8340428 0.70 GAA (0.41) CNOT7GAATAAR1HRH3HSD17B10
SCHEMBL30693612 0.70 CNOT7 (0.43) GPR84CNOT7HCAR2TAAR1HRH3
SCHEMBL10928551 0.69 MAPT (0.46) CNOT7GAATAAR1HRH3MEN1
SCHEMBL2030841 0.69 TAAR1 (0.71) TAAR1HRH3ALDH1A1HPGD

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
EP-0522956-A2 Preparation of 2-(2-thienyl) ethylamine and synthesis of thieno [3,2-C] pyridine derivatives therefrom SANOFI (FR) 1993-01-13 EP disclosed