SCHEMBL4860561

SCHEMBL4860561

COc1ccc(C2c3ccc(N(C)C)cc3-c3cc(N(C)C)ccc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.49
APP P05067 2/20 0.45
MAPT P10636 4/20 0.42
TP53 P04637 3/20 0.42
MAOA P21397 3/20 0.42
NPC1 O15118 2/20 0.42
HPGD P15428 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
PTGS2 P35354 1/20 0.42
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
ESR2 Q92731 1/20 0.40
NOX1 Q9Y5S8 1/20 0.40
HSD17B10 Q99714 1/20 0.40
SNCA P37840 1/20 0.39
KDM1A O60341 2/20 0.39
MAOB P27338 2/20 0.39
LMNA P02545 1/20 0.38
MAPK1 P28482 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
SCHEMBL6282600 0.86 ALDH1A1 (0.44) APPMAPTTP53NPC1HPGD
SCHEMBL9658078 0.82 SNCA (0.51) SLC2A1APPMAPTTP53MAOA
SCHEMBL9803812 0.81 ALDH1A1 (0.48) APPMAPTTP53NPC1RAB9A
SCHEMBL9803313 0.80 ALDH1A1 (0.40) HPGDRAB9AKDM4EALDH1A1HSD17B10
SCHEMBL4859207 0.80 ALDH1A1 (0.38) MAPTTP53NPC1HPGDRAB9A
SCHEMBL9803217 0.77 ALDH1A1 (0.43) MAPTTP53HPGDRAB9AKDM4E
SCHEMBL9803590 0.77 ALDH1A1 (0.37) APPMAPTHPGDKDM4EALDH1A1
SCHEMBL9803237 0.77 ALDH1A1 (0.34) APPMAPTTP53NPC1RAB9A
SCHEMBL9657050 0.77 APP (0.48) SLC2A1APPMAPTNPC1HPGD
SCHEMBL10692102 0.76 LMNA (0.44) SLC2A1APPMAPTTP53MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7329289-B2 Use of triarylmethane derivatives as direct dyes in a dye composition, composition and implementation process L'Oréal, S.A. (FR) 2008-02-12 US claimed
EP-1623701-B1 Use of triarylmethane derivatives in colourant compositions, compositions and their methods of use. OREAL (FR) 2007-02-14 EP claimed
EP-1623701-A1 Use of triarylmethane derivatives in colourant compositions, compositions and their methods of use. L'OREAL (FR) 2006-02-08 EP claimed
EP-0232907-B1 HEAT-SENSITIVE RECORDING MATERIAL KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1991-03-27 EP disclosed
US-4761396-A BASIC PHTHALIDE DYE REACTS WITH FLUORENE DERIVATIVE AND P-PHENYLENEDIAMINE DERIVATIVE KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1988-08-02 US disclosed
EP-0232907-A2 Heat-sensitive recording material KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1987-08-19 EP disclosed