SCHEMBL16656115

SCHEMBL16656115

O=c1[nH]c2ccc(Br)cc2c(O)c1-c1cccc(CC(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
FASN P49327 2/20 0.44
MAPT P10636 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL16632006 0.83 KDM4E (0.49) KDM4EFASNMAPTMEN1KMT2A
SCHEMBL16656114 0.81 KDM4E (0.46) KDM4EFASNMAPTMEN1KMT2A
SCHEMBL15648185 0.79 KDM4E (0.70) KDM4EFASNMAPTMEN1KMT2A
SCHEMBL15647838 0.79 KDM4E (0.66) KDM4EFASNMAPTMEN1KMT2A
SCHEMBL16652131 0.77 ALDH1A1 (0.43) KDM4EMAPTMEN1KMT2A
SCHEMBL16651582 0.69 GSK3B (0.40) KDM4EMAPTMEN1KMT2A
SCHEMBL8783594 0.69 MAPT (0.68) KDM4EFASNMAPTMEN1KMT2A
SCHEMBL16460645 0.69 PTGES (0.58) KDM4EFASNMAPTMEN1KMT2A
SCHEMBL15648890 0.69 ALDH1A1 (0.72) KDM4EMAPTMEN1KMT2A
SCHEMBL4458154 0.69 KDM4E (0.65) KDM4EFASNMAPT

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-3057950-A1 PHENYL LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T Janssen Pharmaceutica N.V. (BE) 2016-08-24 EP disclosed
WO-2015057203-A1 PHENYL LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T JANSSEN PHARMACEUTICA NV (BE) 2015-04-23 WO disclosed