SCHEMBL8896465

SCHEMBL8896465

COc1cc(C(F)(F)F)cc(OC)c1-c1csc(N)n1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.51
ALDH1A1 P00352 4/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MPL P40238 5/20 0.48
KDM4E B2RXH2 1/20 0.47
LTA4H P09960 5/20 0.43
POLB P06746 2/20 0.43
MAPT P10636 2/20 0.43
GFER P55789 1/20 0.41
GAA P10253 1/20 0.40
RORB Q92753 1/20 0.38
HTT P42858 1/20 0.36

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
SCHEMBL8894861 0.81 MEN1 (0.54) HSD17B10ALDH1A1MEN1KMT2ANPC1
SCHEMBL2379547 0.81 ALDH1A1 (0.56) HSD17B10ALDH1A1MEN1KMT2ANPC1
SCHEMBL8896650 0.81 ALDH1A1 (0.63) HSD17B10ALDH1A1MEN1KMT2ANPC1
SCHEMBL23364762 0.81 MPL (0.53) HSD17B10ALDH1A1MEN1KMT2ANPC1
SCHEMBL1801097 0.78 MPL (0.65) HSD17B10ALDH1A1MEN1KMT2ANPC1
SCHEMBL17386849 0.77 RAB9A (0.55) HSD17B10ALDH1A1MEN1KMT2ANPC1
SCHEMBL2762616 0.76 MPL (0.51) HSD17B10ALDH1A1MEN1KMT2ANPC1
SCHEMBL16644714 0.74 MEN1 (0.50) HSD17B10ALDH1A1MEN1KMT2ANPC1
SCHEMBL3278201 0.74 LTA4H (0.58) HSD17B10ALDH1A1MEN1KMT2ANPC1
SCHEMBL14993071 0.74 HSD17B10 (0.52) HSD17B10ALDH1A1MEN1KMT2ANPC1

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
US-5656648-A TREATMENT OF PATHOLOGIES NECESSITATING STIMULATION OF CHOLECYSTOKININ-A RECEPTORS BY TOTAL OR PARTIAL AGONIST EFFECT SANOFI (FR) 1997-08-12 US disclosed
CN-1107158-A Polysubstituted 2-amino-thiazole derivatives SANOFI ELF (FR) 1995-08-23 CN disclosed
EP-0611766-A1 Polysubstituted 2-amido thiazoles derivatives, process for their preparation, pharmaceutical compositions and utilization for the preparation of a medicament SANOFI (FR) 1994-08-24 EP disclosed