SCHEMBL20816366

SCHEMBL20816366

Nc1nnnn1C1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.53
ALDH1A1 P00352 5/20 0.50
MAPT P10636 2/20 0.50
TP53 P04637 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
ADORA2A P29274 1/20 0.39

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
SCHEMBL1013139 0.75 TSHR (0.53) TSHRALDH1A1MAPTTP53L3MBTL1
SCHEMBL16426472 0.75 TSHR (0.53) TSHRALDH1A1MAPTTP53L3MBTL1
SCHEMBL25218201 0.75 ALDH1A1 (0.63) TSHRALDH1A1MAPTTP53L3MBTL1
SCHEMBL13997161 0.73 L3MBTL1 (0.59) TSHRALDH1A1MAPTTP53L3MBTL1
SCHEMBL5835202 0.73 TSHR (0.51) TSHRALDH1A1MAPTTP53L3MBTL1
SCHEMBL1223219 0.72 TSHR (0.50) TSHRALDH1A1MAPTTP53L3MBTL1
SCHEMBL22113418 0.72 TSHR (0.50) TSHRALDH1A1MAPTTP53L3MBTL1
SCHEMBL22096535 0.71 TSHR (0.45) TSHRALDH1A1MAPTTP53L3MBTL1
SCHEMBL24938345 0.71 TSHR (0.45) TSHRALDH1A1MAPTTP53L3MBTL1
SCHEMBL15014082 0.71 ALDH1A1 (0.63) TSHRALDH1A1MAPTTP53L3MBTL1

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-20190085208-A1 POLISHING COMPOSITION, METHOD FOR PRODUCING SAME, POLISHING METHOD, AND METHOD FOR PRODUCING SUBSTRATE FUJIMI INCORPORATED (JP) 2019-03-21 US disclosed