SCHEMBL7601650

SCHEMBL7601650

c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3c(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)c4ccccc4c4ccccc34)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
CYP1A2 P05177 3/20 0.38
CYP3A4 P08684 3/20 0.38
MAPT P10636 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
KDM4E B2RXH2 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
MGLL Q99685 1/20 0.38
TAAR1 Q96RJ0 3/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MMP3 P08254 1/20 0.37
BCL2L1 Q07817 1/20 0.37
HPGD P15428 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34

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
SCHEMBL762889 0.98 ALDH1A1 (0.41) ALDH1A1CYP1A2CYP3A4MAPTTDP1
SCHEMBL14867170 0.93 ALDH1A1 (0.43) ALDH1A1CYP1A2CYP3A4MAPTTDP1
SCHEMBL5372146 0.93 ALDH1A1 (0.43) ALDH1A1CYP1A2CYP3A4MAPTTDP1
SCHEMBL804831 0.91 ALDH1A1 (0.43) ALDH1A1CYP1A2CYP3A4MAPTTDP1
SCHEMBL22671493 0.88 ACHE (0.36) ALDH1A1CYP1A2CYP3A4MAPTTDP1
SCHEMBL22670071 0.88 ACHE (0.36) ALDH1A1CYP1A2CYP3A4MAPTTDP1
SCHEMBL21123719 0.88 ACHE (0.36) ALDH1A1CYP1A2CYP3A4MAPTTDP1
SCHEMBL22670513 0.88 ACHE (0.36) ALDH1A1CYP1A2CYP3A4MAPTTDP1
SCHEMBL14446780 0.87 ALDH1A1 (0.38) ALDH1A1CYP1A2CYP3A4MAPTTDP1
SCHEMBL22671913 0.86 ALDH1A1 (0.36) ALDH1A1CYP1A2CYP3A4MAPTTDP1

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-0757035-B1 Phenanthrylenediamine derivative and electrophotosensitive material using the same KYOCERA MITA CORP (JP) 2002-12-04 EP disclosed
US-5843606-A Phenanthrylenediamine derivative MITA INDUSTRIAL CO., LTD. (JP) 1998-12-01 US disclosed
EP-0757035-A1 Phenanthrylenediamine derivative and electrophotosensitive material using the same MITA INDUSTRIAL CO., LTD. (JP) 1997-02-05 EP disclosed