SCHEMBL6414485

SCHEMBL6414485

CCCCCCCCCCCCCCCCCCCc1ccnc(-c2cc(C(=O)OCC)cc(-c3cc(C(=O)OCC)cc(-c4cc(CCCCCCCCCCCCCCCCCCC)ccn4)n3)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
JMJD6 Q6NYC1 5/20 0.49
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47
PPARA Q07869 4/20 0.46
PPARG P37231 3/20 0.46
PLA2G4A P47712 1/20 0.43
LMNA P02545 1/20 0.41
ESR1 P03372 1/20 0.40
KDM5B Q9UGL1 1/20 0.40
LNPEP Q9UIQ6 1/20 0.40
PIK3CA P42336 1/20 0.40

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
SCHEMBL3442984 1.00 JMJD6 (0.49) JMJD6CYP4F2CYP4A11PPARAPPARG
SCHEMBL6417046 0.98 JMJD6 (0.53) JMJD6CYP4F2CYP4A11PPARAPPARG
SCHEMBL3442954 0.98 JMJD6 (0.53) JMJD6CYP4F2CYP4A11PPARAPPARG
SCHEMBL6417072 0.97 JMJD6 (0.52) JMJD6CYP4F2CYP4A11PPARAPPARG
SCHEMBL3442274 0.95 JMJD6 (0.53) JMJD6CYP4F2CYP4A11PPARAPPARG
SCHEMBL6414691 0.95 JMJD6 (0.53) JMJD6CYP4F2CYP4A11PPARAPPARG
SCHEMBL6413811 0.92 JMJD6 (0.47) JMJD6CYP4F2CYP4A11PPARAPPARG
SCHEMBL6417888 0.92 JMJD6 (0.47) JMJD6CYP4F2CYP4A11PPARAPPARG
SCHEMBL13105132 0.92 CYP4F2 (0.48) JMJD6CYP4F2CYP4A11PPARAPPARG
SCHEMBL6419056 0.85 JMJD6 (0.53) JMJD6CYP4F2CYP4A11PPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050139257-A1 Photosensitizing transition metal complex containing quaterpyridine and photovoltaic cell with the metal complex SHARP KABUSHIKI KAISHA (JP) 2005-06-30 US disclosed