SCHEMBL7010799

SCHEMBL7010799

Cc1ccccc1N(c1ccc(-c2ccc(Nc3ccc(N)cc3)cc2)cc1)c1ccccc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
MAPT P10636 6/20 0.46
CYP3A4 P08684 6/20 0.46
L3MBTL1 Q9Y468 4/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
ALOX12 P18054 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 6/20 0.42
KDM4E B2RXH2 2/20 0.42
CYP2D6 P10635 1/20 0.42
KDM1A O60341 3/20 0.40
TP53 P04637 3/20 0.38
HSD17B10 Q99714 2/20 0.38
HPGD P15428 2/20 0.38
ALOX15 P16050 2/20 0.38
NR4A1 P22736 1/20 0.38
APP P05067 1/20 0.38
SNCA P37840 1/20 0.38

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
SCHEMBL7005107 0.94 MAPT (0.51) ALDH1A1MAPTCYP3A4L3MBTL1CYP1A2
SCHEMBL21560802 0.89 HPGD (0.41) ALDH1A1MAPTCYP3A4L3MBTL1CYP1A2
SCHEMBL7010403 0.89 ALDH1A1 (0.48) ALDH1A1MAPTCYP3A4L3MBTL1CYP1A2
SCHEMBL7007115 0.89 MAPT (0.44) ALDH1A1MAPTCYP3A4L3MBTL1CYP1A2
SCHEMBL7011968 0.87 ALDH1A1 (0.50) ALDH1A1MAPTCYP3A4L3MBTL1CYP1A2
SCHEMBL7903705 0.86 ALDH1A1 (0.60) ALDH1A1MAPTCYP3A4L3MBTL1CYP1A2
SCHEMBL5706260 0.85 CYP3A4 (0.56) ALDH1A1MAPTCYP3A4L3MBTL1CYP1A2
SCHEMBL7005760 0.83 NPC1 (0.37) ALDH1A1MAPTHTTTDP1KDM4E
SCHEMBL7004541 0.83 ALDH1A1 (0.60) ALDH1A1MAPTCYP3A4L3MBTL1CYP1A2
SCHEMBL7010070 0.82 MAPT (0.43) ALDH1A1MAPTCYP3A4L3MBTL1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0995786-B1 Electrochromic device NIPPON MITSUBISHI OIL CORP (JP) 2003-01-08 EP disclosed
US-6208452-B1 HAS AN ION CONDUCTIVE LAYER OBTAINED BY CURING A COMPOSITION COMPRISING A BIPYRIDINIUM COMPOUND, A SPECIFIC AMINE COMPOUND AND A PRECURSOR COMPONENT OF A POLYMERIC SOLID ELECTROLYTE DISPOSED BETWEEN TWO ELECTRICALLY CONDUCTIVE SUBSTRATES NIPPON MITSUBISHI OIL CORPORATION (JP) 2001-03-27 US disclosed
US-6203154-B1 MULTILAYER NIPPON MITSUBISHI OIL CORPORATION (JP) 2001-03-20 US disclosed
EP-1041425-A1 ELECTROCHROMIC ELEMENT Nippon Mitsubishi Oil Corporation (JP) 2000-10-04 EP disclosed
EP-0995786-A1 Electrochromic device Nippon Mitsubishi Oil Corporation (JP) 2000-04-26 EP disclosed