SCHEMBL28850872

SCHEMBL28850872

C=CCc1cccs1.CCOC(=O)CO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 7/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
POLB P06746 2/20 0.43
ESR2 Q92731 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
MAPT P10636 2/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
LMNA P02545 1/20 0.39
PPARG P37231 1/20 0.39
NCOA2 Q15596 1/20 0.39
NCOA1 Q15788 1/20 0.39
NPSR1 Q6W5P4 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
Glycolic Acid SCHEMBL11501012 0.81 CYP2C19 (0.47) HSD17B10SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL29660 0.76
Alcohol SCHEMBL29045225 0.76 POLB (0.57) HSD17B10SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL358221 0.76 POLB (0.60) HSD17B10SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL9628677 0.75
Methane SCHEMBL21683042 0.75
Ammonia Solution, Strong SCHEMBL1585279 0.75
SCHEMBL8524441 0.75
Hydrochloric Acid SCHEMBL27656714 0.75
SCHEMBL11546930 0.74 POLB (0.45) HSD17B10SMN1; SMN2ALDH1A1MEN1KMT2A

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-107251190-A The lithographic patterning of electronic installation 正交公司 2017-10-13 CN disclosed