SCHEMBL13415005

SCHEMBL13415005

CCOC(=O)NCc1ccc2[nH]ccc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
KDM4E B2RXH2 2/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C19 P33261 1/20 0.56
ALOX15 P16050 1/20 0.49
MAOA P21397 2/20 0.48
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
ABL1 P00519 1/20 0.46
SRC P12931 1/20 0.46
THRA P10827 2/20 0.46
THRB P10828 2/20 0.46
HDAC1 Q13547 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
CACNA1G O43497 1/20 0.44
CACNA1H O95180 1/20 0.44
CACNA1I Q9P0X4 1/20 0.44
CHRNA7 P36544 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
SCHEMBL2037042 0.84 PPID (0.58) SMN1; SMN2KDM4EALOX15MAOAALDH1A1
SCHEMBL9717422 0.83 HDAC1 (0.51) SMN1; SMN2KDM4EMAOAALDH1A1MAPT
SCHEMBL7214903 0.83 L3MBTL1 (0.49) KDM4EALDH1A1MAPTABL1SRC
SCHEMBL29792562 0.83 L3MBTL1 (0.49) KDM4EALDH1A1MAPTABL1SRC
SCHEMBL6015699 0.81 KDM4E (0.62) KDM4EMAOAALDH1A1MAPTABL1
SCHEMBL7985998 0.79 ENPP2 (0.56) SMN1; SMN2ALOX15MAOAMAPTTHRA
SCHEMBL27596815 0.79 HDAC1 (0.50) KDM4ECYP2C19ALOX15MAOAALDH1A1
SCHEMBL8531291 0.78 ERCC1 (0.56) KDM4EALDH1A1MAPTABL1SRC
SCHEMBL7483289 0.78 MAOA (0.66) CYP1A2CYP3A4CYP2C19MAOAMAPT
SCHEMBL3404704 0.78 EPHX2 (0.58) CYP3A4ALDH1A1MAPTHDAC1CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304171-B2 Plate making method of lithographic printing plate precursor FUJIFILM CORPORATION (JP) 2012-11-06 US disclosed
US-20100075260-A1 PLATE MAKING METHOD OF LITHOGRAPHIC PRINTING PLATE PRECURSOR FUJIFILM CORPORATION (JP) 2010-03-25 US disclosed
US-20100075260-A1 PLATE MAKING METHOD OF LITHOGRAPHIC PRINTING PLATE PRECURSOR FUJIFILM CORPORATION (JP) 2010-03-25 US disclosed