SCHEMBL28291149

SCHEMBL28291149

CCOC(=O)C(=CCc1ccccc1)N(C)C

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
NR1H4 Q96RI1 1/20 0.43
ALDH1A1 P00352 4/20 0.42
MAPT P10636 4/20 0.42
L3MBTL1 Q9Y468 3/20 0.41
LMNA P02545 2/20 0.41
GAA P10253 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
POLB P06746 1/20 0.41
HSD17B10 Q99714 1/20 0.41
DHODH Q02127 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
HPGD P15428 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
SCHEMBL6067639 0.81 MEN1 (0.62) MEN1KMT2ASMN1; SMN2NR1H4ALDH1A1
SCHEMBL4392238 0.80 NPC1 (0.42) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL351793 0.80 MEN1 (0.51) MEN1KMT2ASMN1; SMN2NR1H4ALDH1A1
SCHEMBL8781887 0.79 ALDH1A1 (0.49) MEN1KMT2ANR1H4ALDH1A1MAPT
SCHEMBL17018866 0.78 MEN1 (0.50) MEN1KMT2ASMN1; SMN2NR1H4ALDH1A1
SCHEMBL9587353 0.78 MEN1 (0.68) MEN1KMT2ASMN1; SMN2NR1H4ALDH1A1
SCHEMBL3918527 0.78 MEN1 (0.50) MEN1KMT2ASMN1; SMN2NR1H4ALDH1A1
SCHEMBL9587350 0.78 MEN1 (0.68) MEN1KMT2ASMN1; SMN2NR1H4ALDH1A1
SCHEMBL1295244 0.78 MEN1 (0.50) MEN1KMT2ASMN1; SMN2NR1H4ALDH1A1
SCHEMBL1295249 0.78 MEN1 (0.50) MEN1KMT2ASMN1; SMN2NR1H4ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109592764-A Method and sedimentation agent for methanol-to-olefins chilling water system good antiscale property 艺康美国股份有限公司 2019-04-09 CN claimed
CN-109592764-A Method and sedimentation agent for methanol-to-olefins chilling water system good antiscale property 艺康美国股份有限公司 2019-04-09 CN disclosed