SCHEMBL4778640

SCHEMBL4778640

CNc1ccc(/C=C/C=O)c(NC)c1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.37
CDK4 P11802 2/20 0.35
CCND1 P24385 2/20 0.35
EGFR P00533 2/20 0.34
TRPA1 O75762 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
ALOX5 P09917 1/20 0.31
MAPK1 P28482 1/20 0.31
XDH P47989 1/20 0.31
CCNB2 O95067 1/20 0.30
CDK1 P06493 1/20 0.30
CCNB1 P14635 1/20 0.30
CCNB3 Q8WWL7 1/20 0.30

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
SCHEMBL4778642 1.00 APP (0.37) APPCDK4CCND1EGFRTRPA1
SCHEMBL31450272 1.00 APP (0.37) APPCDK4CCND1EGFRTRPA1
SCHEMBL7672985 0.81 EGFR (0.38) APPEGFRALDH1A1LMNA
SCHEMBL20159071 0.78 CDK4 (0.33) CDK4CCND1
SCHEMBL2097086 0.78 EGFR (0.36) APPEGFR
SCHEMBL2097084 0.78 EGFR (0.36) APPEGFR
SCHEMBL2289235 0.76 CDK4 (0.52) CDK4CCND1EGFRTRPA1ALDH1A1
SCHEMBL2614337 0.76 CDK4 (0.52) CDK4CCND1EGFRTRPA1ALDH1A1
SCHEMBL31193364 0.74 CYP4F2 (0.38) CDK4CCND1ALDH1A1ALOX5CCNB2
SCHEMBL11141597 0.72 ALDH1A1 (0.40) APPALDH1A1LMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103926130-B Method and the detection method of biotin is extracted with molasses for raw material 山东师范大学 2016-09-07 CN claimed
CN-103926369-B Extraction method of biotin in molasses and thin layer chromatography (TLC) scanning detection method thereof UNIV SHANDONG NORMAL 2015-06-17 CN claimed
CN-103926367-B Method for extracting biotin from molasses and thin layer chromatography (TLC) scanning detection method of biotin UNIV SHANDONG NORMAL 2015-05-27 CN claimed
CN-103926368-B Method for extracting biotin from corn steep liquor and thin layer chromatography (TLC) scanning detection method of biotin UNIV SHANDONG NORMAL 2015-05-27 CN claimed
CN-103926130-B Method and the detection method of biotin is extracted with molasses for raw material 山东师范大学 2016-09-07 CN disclosed
CN-103926369-B Extraction method of biotin in molasses and thin layer chromatography (TLC) scanning detection method thereof UNIV SHANDONG NORMAL 2015-06-17 CN disclosed
CN-103926367-B Method for extracting biotin from molasses and thin layer chromatography (TLC) scanning detection method of biotin UNIV SHANDONG NORMAL 2015-05-27 CN disclosed
CN-103926368-B Method for extracting biotin from corn steep liquor and thin layer chromatography (TLC) scanning detection method of biotin UNIV SHANDONG NORMAL 2015-05-27 CN disclosed
WO-2008011074-A2 HISTONE DEACETYLASE INHIBITORS ERRANT GENE THERAPEUTICS, LLC (US) 2008-01-24 WO disclosed
EP-1817020-A2 HISTONE DEACETYLASE INHIBITORS Errant Gene Therapeutics, Inc. (US) 2007-08-15 EP disclosed
WO-2006052916-A2 HISTONE DEACETYLASE INHIBITORS ERRANT GENE THERAPEUTICS, INC. (US) 2006-05-18 WO disclosed