SCHEMBL7006142

SCHEMBL7006142

Nc1ccc(N(c2ccccc2)c2ccccc2N(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.77
MAPT P10636 6/20 0.77
CYP3A4 P08684 5/20 0.77
TDP1 Q9NUW8 5/20 0.77
L3MBTL1 Q9Y468 4/20 0.77
CYP1A2 P05177 2/20 0.77
CYP2C9 P11712 2/20 0.77
CYP2C19 P33261 2/20 0.77
KDM4E B2RXH2 1/20 0.77
CYP2D6 P10635 1/20 0.77
TSHR P16473 2/20 0.46
TAAR1 Q96RJ0 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MAPK1 P28482 2/20 0.43
PSMD14 O00487 1/20 0.43
RECQL P46063 1/20 0.43
GFER P55789 1/20 0.43
TP53 P04637 1/20 0.42
ALOX15 P16050 1/20 0.42
MAOB P27338 5/20 0.39

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
SCHEMBL7009406 0.90 ALDH1A1 (0.63) ALDH1A1MAPTCYP3A4TDP1L3MBTL1
SCHEMBL7008498 0.90 TDP1 (0.63) ALDH1A1MAPTCYP3A4TDP1L3MBTL1
SCHEMBL7013209 0.90 ALDH1A1 (0.63) ALDH1A1MAPTCYP3A4TDP1L3MBTL1
SCHEMBL7009656 0.88 CYP3A4 (0.61) ALDH1A1MAPTCYP3A4TDP1L3MBTL1
SCHEMBL21311961 0.87 CYP3A4 (1.00) ALDH1A1MAPTCYP3A4TDP1L3MBTL1
SCHEMBL22733783 0.87 CYP3A4 (1.00) ALDH1A1MAPTCYP3A4TDP1L3MBTL1
Benzene SCHEMBL1030385 0.87 CYP3A4 (1.00) ALDH1A1MAPTCYP3A4TDP1L3MBTL1
SCHEMBL21538632 0.87 CYP3A4 (1.00) ALDH1A1MAPTCYP3A4TDP1L3MBTL1
SCHEMBL63421 0.87 CYP3A4 (1.00) ALDH1A1MAPTCYP3A4TDP1L3MBTL1
SCHEMBL9902747 0.87 CYP3A4 (1.00) ALDH1A1MAPTCYP3A4TDP1L3MBTL1

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