SCHEMBL20428133

SCHEMBL20428133

CC(COCc1c[nH]cn1)CSCc1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.32
PPARG P37231 2/20 0.32
GLA P06280 1/20 0.32
ACE P12821 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.31
TACR1 P25103 2/20 0.31
METAP2 P50579 1/20 0.31

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
SCHEMBL24428718 1.00 PPARA (0.32) PPARAPPARGGLAACENPC1
SCHEMBL19830204 0.85 NPC1 (0.32) PPARAPPARGNPC1RAB9ASMN1; SMN2
SCHEMBL14028299 0.74 HSD17B10 (0.43) GLANPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL24180375 0.72 MAPT (0.39) PPARAPPARGACESMN1; SMN2HSD17B10
SCHEMBL28061468 0.70 CYP2C19 (0.51) GLANPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL20408407 0.70 ACE (0.46) PPARAPPARGACEMETAP2
SCHEMBL8483117 0.70 IDO1 (0.42) TACR1
SCHEMBL9029161 0.67 TSHR (0.48) NPC1RAB9ASMN1; SMN2
SCHEMBL649075 0.67 ALDH1A1 (0.46) RAB9ASMN1; SMN2
SCHEMBL11104061 0.66 ADRA2A (0.35) TACR1

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
EP-3354644-A1 CLEAVABLE LIPIDS Translate Bio, Inc. (US) 2018-08-01 EP disclosed