SCHEMBL12758232

SCHEMBL12758232

CCCCCCCCN(/C=C/C=C1C(=O)OC(C)(C)OC1=O)CCCCCCCC

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 6/20 0.43
CDC25B P30305 5/20 0.43
ACP1 P24666 4/20 0.43
APP P05067 1/20 0.38
ALDH1A1 P00352 5/20 0.33
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 2/20 0.33
HPGD P15428 2/20 0.33
CYP2C19 P33261 2/20 0.33
KMT2A Q03164 2/20 0.33
CRHBP P24387 2/20 0.33
CRHR2 Q13324 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
CYP2C9 P11712 1/20 0.33
TYR P14679 1/20 0.32
ACAT1 P24752 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL24416732 0.94 APP (0.40) PTPN1CDC25BACP1APPALDH1A1
SCHEMBL21128873 0.81 APP (0.43) PTPN1CDC25BACP1APPALDH1A1
SCHEMBL19240037 0.78 ALDH1A1 (0.39) APPALDH1A1KMT2ATDP1L3MBTL1
SCHEMBL12758250 0.76 PTGS1 (0.35) TDP1L3MBTL1POLB
SCHEMBL19240085 0.73 APP (0.38) APP
SCHEMBL4544722 0.72 APP (0.41) APPALDH1A1HPGDKMT2ATDP1
SCHEMBL9892476 0.69 APP (0.37) APPALDH1A1CRHBPCRHR2L3MBTL1
SCHEMBL19240042 0.67
SCHEMBL10379497 0.67 DNM1 (0.52) ALDH1A1
SCHEMBL20786806 0.65 PTPN1 (0.46) PTPN1CDC25BACP1ALDH1A1CYP1A2

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
US-20110057155-A1 ULTRAVIOLET ABSORBENT COMPOSITION FUJIFILM CORPORATION (JP) 2011-03-10 US disclosed