SCHEMBL29201828

SCHEMBL29201828

OCSSc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.55
HSD17B10 Q99714 2/20 0.55
MAPT P10636 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MGLL Q99685 1/20 0.55
ALDH1A1 P00352 2/20 0.42
MAPK1 P28482 1/20 0.42
FFAR1 O14842 1/20 0.39
TSHR P16473 1/20 0.38
APOBEC3G Q9HC16 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
MTNR1A P48039 4/20 0.33
MTNR1B P49286 4/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C9 P11712 1/20 0.32
MAOA P21397 1/20 0.32

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
SCHEMBL20150448 0.80 SMN1; SMN2 (0.50) HPGDHSD17B10MAPTSMN1; SMN2MGLL
Alcohol SCHEMBL28170517 0.76 HPGD (0.67) HPGDHSD17B10MAPTSMN1; SMN2MGLL
SCHEMBL29064503 0.74 MAPT (0.55) HPGDHSD17B10MAPTSMN1; SMN2MGLL
SCHEMBL27499961 0.74 SMN1; SMN2 (0.55) HPGDHSD17B10MAPTSMN1; SMN2MGLL
SCHEMBL10700265 0.74 SMN1; SMN2 (0.55) HPGDHSD17B10MAPTSMN1; SMN2MGLL
SCHEMBL575878 0.74 SMN1; SMN2 (0.55) HPGDHSD17B10MAPTSMN1; SMN2MGLL
SCHEMBL776044 0.74 MAPT (0.55) HPGDHSD17B10MAPTSMN1; SMN2MGLL
SCHEMBL20753263 0.73 MAPT (0.42) HPGDHSD17B10MAPTSMN1; SMN2MGLL
SCHEMBL4884474 0.73 FFAR1 (0.61) HPGDHSD17B10MAPTSMN1; SMN2MGLL
SCHEMBL575899 0.73 HPGD (0.48) HPGDHSD17B10MAPTSMN1; SMN2MGLL

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-117447674-A Polyurethane elastomer composition, polyurethane elastomer and preparation method of polyurethane elastomer 万华化学集团股份有限公司 2024-01-26 CN disclosed