SCHEMBL21664337

SCHEMBL21664337

C=C(NC)c1cc(C)sc1-c1ccc(C)s1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
GFER P55789 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
RXFP1 Q9HBX9 1/20 0.31
GAA P10253 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
PRMT6 Q96LA8 1/20 0.30

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
SCHEMBL10024213 0.75 KMT2A (0.48) NPC1ALDH1A1MAPTMEN1KMT2A
SCHEMBL14216931 0.69 NPC1 (0.39) NPC1ALDH1A1MAPTGFERHSD17B10
SCHEMBL16616959 0.68 MAPT (0.36) NPC1ALDH1A1MAPTGFERHSD17B10
SCHEMBL17428022 0.67 ALDH1A1 (0.38) NPC1ALDH1A1MAPTGFERHSD17B10
SCHEMBL16616805 0.66 NPC1 (0.37) NPC1ALDH1A1MAPTGFERHSD17B10
SCHEMBL16623906 0.66 ALDH1A1 (0.46) NPC1ALDH1A1MAPTGFERHSD17B10
SCHEMBL13058796 0.65 ALDH1A1 (0.39) NPC1ALDH1A1MAPTGFERHSD17B10
Hydrochloric Acid SCHEMBL16616922 0.65 ALDH1A1 (0.44) NPC1ALDH1A1MAPTGFERHSD17B10
SCHEMBL14602350 0.63 KMT2A (0.47) NPC1ALDH1A1MAPTMEN1KMT2A
SCHEMBL29764 0.62 NPC1 (0.52) NPC1ALDH1A1MAPTGFERHSD17B10

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-2020026752-A1 PHOTOELECTRIC CONVERSION ELEMENT, PHOTOELECTRIC CONVERSION ELEMENT MODULE, ORGANIC THIN-FILM SOLAR CELL, ELECTRONIC APPARATUS, AND POWER SUPPLY MODULE RICOH COMPANY, LTD. (JP) 2020-02-06 WO disclosed