SCHEMBL7459447

SCHEMBL7459447

Cc1ccnc(-c2cc(C)ccn2)c1.O=C(O)c1ccnc(-c2cc(C(=O)O)ccn2)c1.O=C(O)c1ccnc(-c2cc(C(=O)O)ccn2)c1.[Ru]

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JMJD6 Q6NYC1 1/20 0.64
KDM4C Q9H3R0 9/20 0.63
KDM5C P41229 7/20 0.63
KDM2A Q9Y2K7 5/20 0.63
KDM3A Q9Y4C1 5/20 0.63
KDM4E B2RXH2 5/20 0.63
KDM6B O15054 4/20 0.63
KDM4A O75164 6/20 0.62
CCR1 P32246 1/20 0.61
CCR5 P51681 1/20 0.61
CCR8 P51685 1/20 0.61
KDM5B Q9UGL1 8/20 0.60
KDM4B O94953 3/20 0.60
P4HA1 P13674 1/20 0.60
KDM5A P29375 5/20 0.56
KDM2B Q8NHM5 2/20 0.55
TET3 O43151 1/20 0.52
BBOX1 O75936 1/20 0.52
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52

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
SCHEMBL647098 0.98 JMJD6 (0.66) JMJD6KDM4CKDM5CKDM2AKDM3A
SCHEMBL29421652 0.98 JMJD6 (0.66) JMJD6KDM4CKDM5CKDM2AKDM3A
SCHEMBL8572040 0.92 KDM5B (0.60) JMJD6KDM4CKDM5CKDM2AKDM3A
SCHEMBL12993110 0.92 KDM5B (0.60) JMJD6KDM4CKDM5CKDM2AKDM3A
SCHEMBL38661978 0.92 KDM5B (0.60) JMJD6KDM4CKDM5CKDM2AKDM3A
Dipyridyl SCHEMBL3957155 0.91 KDM4C (0.79) JMJD6KDM4CKDM5CKDM2AKDM3A
Dipyridyl SCHEMBL3947377 0.89 KDM4C (0.82) JMJD6KDM4CKDM5CKDM2AKDM3A
SCHEMBL528023 0.89 KDM4C (0.75) JMJD6KDM4CKDM5CKDM2AKDM3A
SCHEMBL5670010 0.89 KDM4C (0.75) JMJD6KDM4CKDM5CKDM2AKDM3A
SCHEMBL4434507 0.89 KDM4C (0.75) JMJD6KDM4CKDM5CKDM2AKDM3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1247137-A1 SELF BLEACHING PHOTOELECTROCHEMICAL-ELECTROCHROMIC DEVICE Midwest Research Institute (US) 2002-10-09 EP disclosed
US-6369934-B1 Self bleaching photoelectrochemical-electrochromic device MIDWEST RESEARCH INSTITUTE 2002-04-09 US disclosed
WO-2002010852-A1 SELF BLEACHING PHOTOELECTROCHEMICAL-ELECTROCHROMIC DEVICE MIDWEST RESEARCH INSTITUTE (US) 2002-02-07 WO disclosed
WO-1997045767-A1 PHOTOELECTROCHEMICAL-ELECTROCHROMIC DEVICE MIDWEST RESEARCH INSTITUTE (US) 1997-12-04 WO disclosed