SCHEMBL31487019

SCHEMBL31487019

CCOc1ccc2sc(C)nc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.59
HSD17B10 Q99714 5/20 0.53
ALDH1A1 P00352 5/20 0.53
KMT2A Q03164 5/20 0.53
TP53 P04637 3/20 0.53
CYP3A4 P08684 2/20 0.53
TSHR P16473 2/20 0.53
MAPT P10636 6/20 0.50
SMN1; SMN2 Q16637 5/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
HPGD P15428 5/20 0.48
PKM P14618 3/20 0.48
MEN1 O00255 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
KDM4E B2RXH2 2/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
LMNA P02545 1/20 0.47

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
SCHEMBL8244075 1.00 PDE10A (0.59) PDE10AHSD17B10ALDH1A1KMT2ATP53
SCHEMBL31486540 0.87 PDE10A (0.56) PDE10AHSD17B10ALDH1A1KMT2ATP53
SCHEMBL10158220 0.87 PDE10A (0.56) PDE10AHSD17B10ALDH1A1KMT2ATP53
SCHEMBL12111148 0.87 PDE10A (0.56) PDE10AHSD17B10ALDH1A1KMT2ATP53
SCHEMBL8261943 0.87 KMT2A (0.69) HSD17B10ALDH1A1KMT2ATP53CYP3A4
SCHEMBL95592 0.85 PDE10A (0.58) PDE10AHSD17B10ALDH1A1KMT2ATP53
SCHEMBL95167 0.83 PDE10A (0.55) PDE10AHSD17B10ALDH1A1KMT2ATP53
SCHEMBL2608913 0.83 PDE10A (0.55) PDE10AHSD17B10ALDH1A1TP53CYP3A4
SCHEMBL6386621 0.83 PDE10A (0.55) PDE10AHSD17B10ALDH1A1KMT2ATP53
SCHEMBL4307797 0.83 HSD17B10 (0.56) PDE10AHSD17B10ALDH1A1KMT2ATP53

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
US-20250135059-A1 COMPOSITIONS COMPRISING FRAGRANCE MATERIALS THE PROCTER & GAMBLE COMPANY 2025-05-01 US disclosed