SCHEMBL5023770

SCHEMBL5023770

O=C(c1ccc2[nH]c(=O)nc(-c3cccc(Cl)c3)c2c1)c1ccc(Cl)s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.52
HSD17B10 Q99714 2/20 0.52
MEN1 O00255 1/20 0.52
CASP1 P29466 1/20 0.52
KMT2A Q03164 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
PDE4A P27815 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
RORB Q92753 3/20 0.39
CSNK2A2 P19784 1/20 0.39
CSNK2B P67870 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
PGR P06401 1/20 0.38
TDO2 P48775 1/20 0.37
BRD4 O60885 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
ERBB2 P04626 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
SCHEMBL4898281 0.85 KDM4E (0.62) KDM4EHSD17B10MEN1CASP1KMT2A
SCHEMBL3552671 0.82 KDM4E (0.55) KDM4EHSD17B10MEN1CASP1KMT2A
SCHEMBL5654518 0.82 KDM4E (0.55) KDM4EHSD17B10MEN1CASP1KMT2A
SCHEMBL3559250 0.82 KDM4E (0.55) KDM4EHSD17B10MEN1CASP1KMT2A
SCHEMBL7205333 0.82 MEN1 (0.49) MEN1KMT2AHPGDPGRBRD4
SCHEMBL5023267 0.80 CSNK2A2 (0.43) KDM4EKMT2APDE4APDE4CPDE4D
SCHEMBL3556688 0.80 MEN1 (0.52) KDM4EHSD17B10MEN1CASP1KMT2A
SCHEMBL5550324 0.79 KDM4E (0.51) KDM4EHSD17B10MEN1CASP1KMT2A
SCHEMBL5658015 0.78 NPSR1 (0.50) KDM4EHSD17B10MEN1CASP1KMT2A
SCHEMBL5026927 0.74 MEN1 (0.65) KDM4EHSD17B10MEN1CASP1KMT2A

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-1322650-B1 FARNESYL TRANSFERASE INHIBITING 6-HETEROCYCLYLMETHYL QUINOLINE AND QUINAZOLINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2008-09-24 EP disclosed
US-7196094-B2 Farnesyl transferase inhibiting 6-heterocyclylmethyl quinoline and quinazoline derivatives JANSSEN PHARMACEUTICA, N.V. (BE) 2007-03-27 US disclosed
EP-1322650-A2 FARNESYL TRANSFERASE INHIBITING 6-HETEROCYCLYLMETHYL QUINOLINE AND QUINAZOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2003-07-02 EP disclosed
WO-2002024686-A2 FARNESYL TRANSFERASE INHIBITING 6-HETEROCYCLYLMETHYL QUINOLINE AND QUINAZOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2002-03-28 WO disclosed