SCHEMBL14976243

SCHEMBL14976243

COC(=O)c1ccnc(-c2cc(C(=O)OC)cc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 3/20 0.51
KDM4E B2RXH2 2/20 0.51
KDM6B O15054 2/20 0.51
KDM5C P41229 2/20 0.51
KDM2A Q9Y2K7 2/20 0.51
KDM3A Q9Y4C1 2/20 0.51
JMJD6 Q6NYC1 2/20 0.46
TLR2 O60603 1/20 0.44
TLR1 Q15399 1/20 0.44
KDM5B Q9UGL1 1/20 0.43
NOTUM Q6P988 2/20 0.42
PHGDH O43175 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
DGAT2 Q96PD7 2/20 0.39
LMNA P02545 1/20 0.39
CFTR P13569 2/20 0.39
KDM1A O60341 1/20 0.39
HDAC1 Q13547 1/20 0.39
PDK2 Q15119 1/20 0.38
MAOB P27338 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
SCHEMBL714108 0.80 KDM4E (0.76) KDM4CKDM4EKDM6BKDM5CKDM2A
SCHEMBL30774379 0.80 KDM4E (0.76) KDM4CKDM4EKDM6BKDM5CKDM2A
Hydrochloric Acid SCHEMBL580962 0.80 KDM4E (0.53) KDM4CKDM4EKDM6BKDM5CKDM2A
Hydrochloric Acid SCHEMBL581889 0.79 KDM4E (0.52) KDM4CKDM4EKDM6BKDM5CKDM2A
SCHEMBL14977180 0.78 KDM4E (0.57) KDM4CKDM4EKDM6BKDM5CKDM2A
SCHEMBL31211653 0.77 KDM4E (0.56) KDM4CKDM4EKDM6BKDM5CKDM2A
SCHEMBL2409737 0.77 KDM4E (0.56) KDM4CKDM4EKDM6BKDM5CKDM2A
SCHEMBL581356 0.77 KDM4C (0.58) KDM4CKDM4EKDM6BKDM5CKDM2A
SCHEMBL14976536 0.77 KDM4E (0.56) KDM4CKDM4EKDM6BKDM5CKDM2A
Bicarbonate SCHEMBL580920 0.76 KDM4E (0.49) KDM4CKDM4EKDM6BKDM5CKDM2A

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
WO-2013076197-A1 DYE COMPOUNDS, METHOD OF MAKING THE SAME, AND THEIR USE IN DYE-SENSITIZED SOLAR CELLS SOLVAY SA (BE) 2013-05-30 WO disclosed