SCHEMBL20769737

SCHEMBL20769737

COC(C)(C)c1csc(N)n1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.47
SMN1; SMN2 Q16637 5/20 0.43
NOS1 P29475 1/20 0.43
ALDH1A1 P00352 7/20 0.41
NPC1 O15118 6/20 0.41
RAB9A P51151 5/20 0.41
MAPT P10636 3/20 0.41
POLB P06746 1/20 0.41
TSHR P16473 2/20 0.38
GFER P55789 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
KDM4E B2RXH2 1/20 0.35
LTA4H P09960 1/20 0.35
HTT P42858 2/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 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
SCHEMBL10437775 0.82 SMN1; SMN2 (0.42) HSD17B10SMN1; SMN2NOS1ALDH1A1NPC1
SCHEMBL20769683 0.79 SMN1; SMN2 (0.39) HSD17B10SMN1; SMN2NOS1ALDH1A1NPC1
SCHEMBL28683993 0.79 TSHR (0.44) HSD17B10SMN1; SMN2NOS1ALDH1A1NPC1
SCHEMBL77483 0.79 SMN1; SMN2 (0.50) HSD17B10SMN1; SMN2NOS1ALDH1A1NPC1
SCHEMBL4902330 0.78 SMN1; SMN2 (0.38) HSD17B10SMN1; SMN2NOS1ALDH1A1NPC1
SCHEMBL21610734 0.78 HSD17B10 (0.40) HSD17B10SMN1; SMN2ALDH1A1MAPTGFER
SCHEMBL28677024 0.75 TSHR (0.36) HSD17B10SMN1; SMN2NOS1ALDH1A1NPC1
SCHEMBL20908390 0.75 SMN1; SMN2 (0.46) HSD17B10SMN1; SMN2NOS1ALDH1A1NPC1
SCHEMBL3605034 0.75 SMN1; SMN2 (0.46) HSD17B10SMN1; SMN2NOS1ALDH1A1NPC1
SCHEMBL25417242 0.74 SMN1; SMN2 (0.38) HSD17B10SMN1; SMN2NOS1ALDH1A1NPC1

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
WO-2019046668-A1 AMIDE SUBSTITUTED THIAZOLES AS PROTEIN SECRETION INHIBITORS KEZAR LIFE SCIENCES (US) 2019-03-07 WO disclosed