SCHEMBL14739159

SCHEMBL14739159

Cc1ccc(Nc2ccc(Nc3ccccc3)cc2)c(N)c1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 8/20 0.49
ALDH1A1 P00352 7/20 0.49
TDP1 Q9NUW8 5/20 0.49
ALOX15 P16050 3/20 0.49
HTT P42858 2/20 0.49
MAPT P10636 7/20 0.46
L3MBTL1 Q9Y468 4/20 0.46
ALOX12 P18054 3/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
HPGD P15428 2/20 0.46
CYP3A4 P08684 2/20 0.46
HSD17B10 Q99714 4/20 0.43
TSHR P16473 2/20 0.43
PTGS1 P23219 1/20 0.43
SLC6A2 P23975 1/20 0.43
MAPK1 P28482 1/20 0.43
PTGS2 P35354 1/20 0.43
HTR2B P41595 1/20 0.43

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
SCHEMBL11901463 0.73 MAPT (0.55) GAAALDH1A1TDP1ALOX15HTT
SCHEMBL7306513 0.72 GAA (0.55) GAAALDH1A1TDP1ALOX15HTT
SCHEMBL312317 0.72 ALDH1A1 (0.44) GAAALDH1A1TDP1ALOX15HTT
SCHEMBL14062099 0.71 HPGD (0.56) GAAALDH1A1TDP1ALOX15HTT
Benzene SCHEMBL29197172 0.71 GAA (0.62) GAAALDH1A1TDP1ALOX15HTT
SCHEMBL8738783 0.71 GAA (0.62) GAAALDH1A1TDP1ALOX15HTT
SCHEMBL29940926 0.70 HPGD (0.60) GAAALDH1A1TDP1ALOX15HTT
SCHEMBL5697158 0.70 HPGD (0.60) GAAALDH1A1TDP1ALOX15HTT
SCHEMBL11798765 0.70 MAPT (0.56) GAAALDH1A1TDP1ALOX15HTT
SCHEMBL599978 0.70 GAA (0.49) GAAALDH1A1TDP1ALOX15HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871678-B2 Thermosensitive recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2014-10-28 US disclosed
US-20130059728-A1 THERMOSENSITIVE RECORDING MEDIUM NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2013-03-07 US disclosed