SCHEMBL28826499

SCHEMBL28826499

COc1ccc(NC(=O)c2cscn2)cc1OC

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.67
NPC1 O15118 2/20 0.67
RAB9A P51151 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
GRM4 Q14833 7/20 0.65
HSD17B10 Q99714 3/20 0.58
MAPT P10636 2/20 0.58
KMT2A Q03164 4/20 0.57
ALDH1A1 P00352 3/20 0.57
MEN1 O00255 2/20 0.57
CYP1A2 P05177 1/20 0.57
MAPK1 P28482 1/20 0.57
CYP2C19 P33261 1/20 0.57
HDAC6 Q9UBN7 1/20 0.54
KLK7 P49862 1/20 0.54
TP53 P04637 2/20 0.53
LMNA P02545 2/20 0.53
HPGD P15428 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL15701281 0.81 MAPT (0.64) KDM4ENPC1RAB9ASMN1; SMN2MAPT
SCHEMBL5214366 0.78 NPC1 (0.71) KDM4ENPC1RAB9ASMN1; SMN2GRM4
SCHEMBL15701231 0.78 ALDH1A1 (0.57) KDM4ESMN1; SMN2GRM4HSD17B10MAPT
SCHEMBL15707505 0.78 NPC1 (0.52) NPC1RAB9ASMN1; SMN2GRM4MAPT
SCHEMBL29072630 0.78 GRM4 (0.53) KDM4ENPC1RAB9ASMN1; SMN2GRM4
SCHEMBL30580392 0.78 GRM4 (0.53) KDM4ENPC1RAB9ASMN1; SMN2GRM4
SCHEMBL15070508 0.77 RAB9A (0.59) KDM4ENPC1RAB9ASMN1; SMN2GRM4
SCHEMBL12707696 0.77 P4HTM (0.67) KDM4ENPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL15701220 0.76 NPC1 (0.63) KDM4ENPC1RAB9ASMN1; SMN2MAPT
SCHEMBL15886252 0.76 NPC1 (0.50) NPC1RAB9ASMN1; SMN2GRM4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103443107-B Thiazolopyrimidine compound F. HOFFMANN-LA ROCHE AG (CH) 2016-04-20 CN claimed
CN-103443107-B Thiazolopyrimidine compound F. HOFFMANN-LA ROCHE AG (CH) 2016-04-20 CN disclosed