SCHEMBL7005102

SCHEMBL7005102

Cc1ccc(N(c2ccc(N)cc2)c2ccc(-c3ccc(Nc4ccccc4)cc3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.56
CYP3A4 P08684 3/20 0.56
ALDH1A1 P00352 3/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2C9 P11712 2/20 0.56
CYP2C19 P33261 2/20 0.56
ALOX12 P18054 2/20 0.56
HPGD P15428 2/20 0.56
HTT P42858 1/20 0.56
TDP1 Q9NUW8 5/20 0.52
KDM4E B2RXH2 3/20 0.52
CYP2D6 P10635 1/20 0.52
KDM1A O60341 1/20 0.44
GAA P10253 3/20 0.44
HSD17B10 Q99714 4/20 0.42
TAAR1 Q96RJ0 1/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
MAPK1 P28482 2/20 0.41

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
SCHEMBL7007657 0.97 MAPT (0.56) MAPTCYP3A4ALDH1A1L3MBTL1CYP1A2
SCHEMBL7010794 0.94 ACHE (0.46) MAPTCYP3A4ALDH1A1L3MBTL1CYP1A2
SCHEMBL7007111 0.94 ACHE (0.46) MAPTCYP3A4ALDH1A1L3MBTL1CYP1A2
SCHEMBL17616949 0.92 HPGD (0.67) MAPTCYP3A4ALDH1A1L3MBTL1CYP1A2
SCHEMBL16158448 0.92 HPGD (0.67) MAPTCYP3A4ALDH1A1L3MBTL1CYP1A2
SCHEMBL12835464 0.90 HPGD (0.64) MAPTCYP3A4ALDH1A1L3MBTL1CYP1A2
SCHEMBL7005833 0.90 MAPT (0.64) MAPTCYP3A4ALDH1A1L3MBTL1CYP1A2
SCHEMBL13973606 0.90 HPGD (0.64) MAPTCYP3A4ALDH1A1L3MBTL1CYP1A2
SCHEMBL13488154 0.90 HPGD (0.64) MAPTCYP3A4ALDH1A1L3MBTL1CYP1A2
SCHEMBL12955838 0.89 HPGD (0.61) MAPTALDH1A1L3MBTL1ALOX12HPGD

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