SCHEMBL29040643

SCHEMBL29040643

CC(=O)SNc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.52
HSD17B10 Q99714 1/20 0.52
SMN1; SMN2 Q16637 4/20 0.50
TSHR P16473 3/20 0.50
KMT2A Q03164 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
TAAR1 Q96RJ0 2/20 0.50
EPHX1 P07099 2/20 0.50
TP53 P04637 1/20 0.50
EPHX2 P34913 1/20 0.50
CDK9 P50750 1/20 0.50
CLK4 Q9HAZ1 1/20 0.50
CYP3A4 P08684 1/20 0.48
ALOX5 P09917 1/20 0.48
MAPT P10636 2/20 0.47
POLB P06746 1/20 0.45
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 3/20 0.44
GAA P10253 3/20 0.44

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
SCHEMBL11463049 0.77 ALDH1A1 (0.42) NAPRTHSD17B10SMN1; SMN2TSHRKMT2A
SCHEMBL11570110 0.76 SMN1; SMN2 (0.48) NAPRTSMN1; SMN2TSHRKMT2ANPC1
SCHEMBL8782782 0.74 SMN1; SMN2 (0.44) NAPRTHSD17B10SMN1; SMN2TSHRKMT2A
SCHEMBL3226501 0.72
SCHEMBL28101168 0.71 GAA (0.50) HSD17B10SMN1; SMN2TSHRKMT2ANPC1
Diphenylamine SCHEMBL28553827 0.70 MAPT (0.71) NAPRTHSD17B10SMN1; SMN2TSHRKMT2A
Diphenylamine SCHEMBL6904395 0.70 MAPT (0.71) NAPRTHSD17B10SMN1; SMN2TSHRKMT2A
Diphenylamine SCHEMBL374606 0.70 MAPT (0.71) NAPRTHSD17B10SMN1; SMN2TSHRKMT2A
SCHEMBL9915084 0.70 HDAC3 (0.50) HSD17B10SMN1; SMN2TSHRKMT2ANPC1
Acetic Acid SCHEMBL3959213 0.69 TSHR (0.74) NAPRTHSD17B10SMN1; SMN2TSHRKMT2A

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
CN-116507349-A Probiotic bacillus compositions and methods of use 生物编辑有限责任公司 2023-07-28 CN disclosed