SCHEMBL28293724

SCHEMBL28293724

CCCCOC(=O)c1ncc(N)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.50
TSHR P16473 5/20 0.50
CYP1A2 P05177 3/20 0.50
CYP2C19 P33261 3/20 0.50
CYP2C9 P11712 2/20 0.50
CYP3A4 P08684 2/20 0.50
PDE4D Q08499 1/20 0.50
L3MBTL1 Q9Y468 3/20 0.49
ALDH1A1 P00352 4/20 0.48
HSD17B10 Q99714 2/20 0.48
TDP1 Q9NUW8 1/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
KDM4E B2RXH2 2/20 0.45
POLB P06746 2/20 0.45
GLA P06280 1/20 0.45
MAPT P10636 3/20 0.44
ESR1 P03372 4/20 0.44
MAPK1 P28482 2/20 0.44
CYP2D6 P10635 1/20 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
SCHEMBL5879520 0.83 ALDH1A1 (0.50) LMNACYP1A2CYP3A4ALDH1A1NPC1
SCHEMBL13800905 0.76 LMNA (0.47) LMNATSHRCYP1A2CYP2C19CYP2C9
SCHEMBL12394101 0.74 LMNA (0.65) LMNATSHRCYP1A2CYP2C19CYP2C9
SCHEMBL27647394 0.73 L3MBTL1 (0.58) LMNATSHRCYP1A2CYP2C19CYP2C9
SCHEMBL128185 0.72 ALDH1A1 (0.44) LMNATSHRL3MBTL1ALDH1A1TDP1
SCHEMBL27756295 0.72 ESR1 (0.48) LMNATSHRCYP1A2CYP2C19CYP2C9
SCHEMBL27486962 0.72 TSHR (0.43) LMNATSHRCYP1A2CYP2C19CYP2C9
SCHEMBL27486964 0.72 L3MBTL1 (0.45) LMNATSHRCYP1A2CYP2C19CYP2C9
SCHEMBL12350733 0.71 TSHR (0.45) LMNATSHRCYP1A2CYP2C19CYP2C9
SCHEMBL128184 0.71 ALDH1A1 (0.43) LMNATSHRL3MBTL1ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109652166-B Volatile cleaning-free stretching oil and preparation method thereof 东莞市登喜达表面处理科技有限公司 2023-01-06 CN claimed
CN-109652166-A A kind of volatility drawing oil free of cleaning and preparation method thereof 东莞市登喜达表面处理科技有限公司 2019-04-19 CN claimed
CN-109652166-B Volatile cleaning-free stretching oil and preparation method thereof 东莞市登喜达表面处理科技有限公司 2023-01-06 CN disclosed
CN-109652166-A A kind of volatility drawing oil free of cleaning and preparation method thereof 东莞市登喜达表面处理科技有限公司 2019-04-19 CN disclosed