SCHEMBL16095350

SCHEMBL16095350

Cc1nc(-c2cc(C(=O)O)ccn2)c(-c2c(F)cccc2OCC2CC2)[nH]1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 10/20 0.67
▸ KDM5A P29375 3/20 0.52
▸ KDM2B Q8NHM5 2/20 0.48
▸ KDM5B Q9UGL1 2/20 0.45
▸ PDE4D Q08499 1/20 0.41
▸ GUCY1B2 O75343 1/20 0.38
▸ GUCY1A2 P33402 1/20 0.38
▸ GUCY1A1 Q02108 1/20 0.38
▸ GUCY1B1 Q02153 1/20 0.38
▸ KDM4A O75164 2/20 0.38
▸ KMO O15229 1/20 0.36
▸ MAPK14 Q16539 2/20 0.36
▸ GSK3B P49841 1/20 0.36
▸ NR1H4 Q96RI1 2/20 0.36
▸ PIM3 Q86V86 1/20 0.36
▸ PIM2 Q9P1W9 1/20 0.36
▸ MRGPRX4 Q96LA9 1/20 0.36
▸ JMJD6 Q6NYC1 1/20 0.36

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
SCHEMBL16095596 0.86 KDM4C (0.65) KDM4CKDM5AKDM2BKDM5BKDM4A
SCHEMBL16034055 0.80 KDM4C (1.00) KDM4CKDM5AKDM2BKDM5BKDM4A
SCHEMBL16095351 0.76 KDM4C (0.59) KDM4CKDM5AKDM2BKDM5BPDE4D
SCHEMBL17604576 0.71 KDM4C (0.47) KDM4CKDM5AKDM2BMAPK14GSK3B
SCHEMBL16095312 0.70 KDM4C (0.60) KDM4CKDM5AKDM2BKDM5BKDM4A
SCHEMBL17604535 0.70 KDM4C (0.46) KDM4CKDM5AKDM2BMAPK14GSK3B
SCHEMBL16034821 0.69 KDM4C (1.00) KDM4CKDM5AKDM2BKDM5BKDM4A
SCHEMBL16034238 0.69 KDM4C (1.00) KDM4CKDM5AKDM2BKDM5BKDM4A
SCHEMBL16095598 0.69 KDM4C (0.56) KDM4CKDM5AKDM2BKDM5BPDE4D
SCHEMBL16094991 0.68 KDM4C (0.60) KDM4CKDM5AKDM2BKDM5BKDM4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2969007-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals Inc (US) 2016-01-20 — — EP disclosed
WO-2014151945-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-09-25 — — WO disclosed
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