SCHEMBL1033941

SCHEMBL1033941

CCCCc1ccc(Nc2ccccc2)cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.44
HPGD P15428 3/20 0.44
MAPT P10636 7/20 0.42
ALDH1A1 P00352 6/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
AR P10275 1/20 0.42
HSD17B10 Q99714 5/20 0.42
MAPK1 P28482 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ALOX12 P18054 2/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
PTGS1 P23219 1/20 0.42
SLC6A2 P23975 1/20 0.42
PTGS2 P35354 1/20 0.42
HTR2B P41595 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP3A4 P08684 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40

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
SCHEMBL25572272 0.83 MEN1 (0.45) HPGDMAPTMEN1KMT2AL3MBTL1
SCHEMBL19979476 0.81 UNG (0.49) ALDH1A1HSD17B10PTGS1SLC6A2PTGS2
SCHEMBL30392107 0.79 MAPT (0.43) NPSR1HPGDMAPTALDH1A1MEN1
SCHEMBL6535929 0.79 MAPT (0.43) NPSR1HPGDMAPTALDH1A1MEN1
SCHEMBL19979478 0.78 PPARA (0.46) ALDH1A1MEN1KMT2ATSHRPTGS2
SCHEMBL19986528 0.77 TYR (0.58) HPGDMAPTALDH1A1MEN1KMT2A
SCHEMBL24570956 0.77 MAPT (0.55) NPSR1HPGDMAPTALDH1A1MEN1
SCHEMBL21278352 0.76 KCNH3 (0.44) NPSR1HPGDMAPTALDH1A1MEN1
SCHEMBL2539187 0.75 TRPV1 (0.58) NPSR1HPGDMAPTALDH1A1MEN1
Diphenylamine SCHEMBL27999160 0.75 EGFR (0.54) MAPTALDH1A1MEN1KMT2AMAPK1

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
EP-1850185-B1 Imaging member, method of imaging using it and method of making said imaging member XEROX CORP (US) 2011-01-19 EP disclosed
US-20070254226-A1 Imaging member XEROX CORPORATION 2007-11-01 US disclosed
EP-1850185-A2 Imaging Member Xerox Corporation (US) 2007-10-31 EP disclosed