SCHEMBL8109639

SCHEMBL8109639

CCOC(=O)c1sc(NC(=O)c2ccc(C#N)cc2)nc1C

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.73
NPC1 O15118 6/20 0.73
RXFP1 Q9HBX9 4/20 0.73
NPSR1 Q6W5P4 4/20 0.73
SMN1; SMN2 Q16637 10/20 0.71
KDM4E B2RXH2 6/20 0.71
HTT P42858 2/20 0.71
LMNA P02545 1/20 0.69
RAB9A P51151 4/20 0.69
HPGD P15428 4/20 0.64
CASP1 P29466 1/20 0.63
CASP7 P55210 1/20 0.63
HSD17B10 Q99714 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
TP53 P04637 2/20 0.63
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
KIFC1 Q9BW19 1/20 0.60
POLB P06746 1/20 0.59
CASP3 P42574 1/20 0.59

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
SCHEMBL6089260 0.90 ALDH1A1 (0.60) ALDH1A1NPC1RXFP1NPSR1SMN1; SMN2
SCHEMBL28480632 0.84 RAB9A (0.74) ALDH1A1NPC1RXFP1NPSR1SMN1; SMN2
SCHEMBL3584407 0.84 SMN1; SMN2 (0.80) ALDH1A1NPC1RXFP1NPSR1SMN1; SMN2
SCHEMBL4924360 0.84 NPC1 (0.59) ALDH1A1NPC1RXFP1NPSR1SMN1; SMN2
SCHEMBL6089264 0.84 ALDH1A1 (0.54) ALDH1A1NPC1RXFP1NPSR1SMN1; SMN2
SCHEMBL3582251 0.83 SMN1; SMN2 (1.00) ALDH1A1NPC1RXFP1NPSR1SMN1; SMN2
SCHEMBL16607174 0.83 ALDH1A1 (0.75) ALDH1A1NPC1RXFP1NPSR1SMN1; SMN2
SCHEMBL31558296 0.83 ALDH1A1 (0.75) ALDH1A1NPC1RXFP1NPSR1SMN1; SMN2
SCHEMBL14877171 0.83 ALDH1A1 (0.75) ALDH1A1NPC1RXFP1NPSR1SMN1; SMN2
SCHEMBL23742075 0.81 SMN1; SMN2 (0.77) ALDH1A1NPC1RXFP1NPSR1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0649843-B1 THIAZOLINE DERIVATIVE TAISHO PHARMACEUTICAL CO LTD (JP) 2000-09-06 EP disclosed
US-5672712-A ANTIAGGLOMERANTS TAISHO PHARMACEUTICAL CO., LTD. (JP) 1997-09-30 US disclosed
EP-0765875-A1 THIAZOLINE DERIVATIVE TAISHO PHARMACEUTICAL CO. LTD (JP) 1997-04-02 EP disclosed
US-5478945-A Fibrinogen receptor antagonism and cell adhesion factor antagonism TAISHO PHARMACEUTICAL CO., LTD. (JP) 1995-12-26 US disclosed
EP-0649843-A1 THIAZOLINE DERIVATIVE TAISHO PHARMACEUTICAL CO. LTD (JP) 1995-04-26 EP disclosed