SCHEMBL8556724

SCHEMBL8556724

CCc1sc(NC(=O)c2cc3ccccc3n2C(C)=O)nc1-c1ccccc1.O=C1Nc2cccc(c2)O1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
MAPT P10636 3/20 0.41
RORC P51449 1/20 0.38
RAB9A P51151 2/20 0.38
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
RXFP1 Q9HBX9 1/20 0.36
TRPV4 Q9HBA0 4/20 0.35
PLTP P55058 2/20 0.34
CDC25B P30305 1/20 0.34
DUSP3 P51452 1/20 0.34
NPC1 O15118 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL8556721 0.72 TRPV4 (0.44) ALDH1A1HSD17B10HPGDTSHRMAPT
SCHEMBL8557444 0.72 MEN1 (0.65) ALDH1A1HPGDMAPTADORA2AADORA1
SCHEMBL8558589 0.69 MEN1 (0.46) ALDH1A1HSD17B10HPGDTSHRMAPT
SCHEMBL14960379 0.67 ALDH1A1 (0.74) ALDH1A1HSD17B10HPGDTSHRMAPT
SCHEMBL8556719 0.66 GRM5 (0.44) ALDH1A1HSD17B10TSHRMAPTRAB9A
SCHEMBL9125041 0.66 MAPT (0.42) ALDH1A1HSD17B10HPGDTSHRMAPT
SCHEMBL8558581 0.66 KMT2A (0.49) ALDH1A1HSD17B10HPGDTSHRMAPT
SCHEMBL8560935 0.65 ALDH1A1 (0.40) ALDH1A1HSD17B10HPGDTSHRMAPT
SCHEMBL9892859 0.64 ALDH1A1 (0.81) ALDH1A1HSD17B10HPGDTSHRMAPT
SCHEMBL13096474 0.63 ALDH1A1 (0.65) ALDH1A1HSD17B10HPGDTSHRMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0518731-B1 2-(Indol-2-yl-carbonylamino)-thiazole derivatives, their preparation and pharmaceutical compositions containing them SANOFI SA (FR) 1998-08-26 EP disclosed
US-5380736-A Cholecystokinin and gastric antagonist ELF SANOFI (FR) 1995-01-10 US disclosed
US-5314889-A Hormone antagonists ELF SANOFI (FR) 1994-05-24 US disclosed
EP-0518731-A1 Heterocyclic derivatives of substituted 2-acylamino 5-thiazole, their preparation and pharmaceutical compositions containing them SANOFI (FR) 1992-12-16 EP disclosed