SCHEMBL6960853

SCHEMBL6960853

COc1ccc(-c2cc(NC(=O)Oc3ccccc3)n[nH]2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.64
CSNK2A1 P68400 1/20 0.64
NPY5R Q15761 2/20 0.64
KDR P35968 2/20 0.55
FLT3 P36888 2/20 0.55
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
PKM P14618 1/20 0.55
MAPK1 P28482 1/20 0.55
KMT2A Q03164 1/20 0.55
FLT1 P17948 1/20 0.55
TNIK Q9UKE5 2/20 0.54
HPGDS O60760 1/20 0.54
ALDH1A1 P00352 1/20 0.53
GAA P10253 1/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
CHRNA3 P32297 2/20 0.52

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
SCHEMBL1666395 0.80 CSNK2A2 (0.90) CSNK2A2CSNK2A1NPY5RMEN1LMNA
SCHEMBL7930564 0.79 CSNK2A2 (0.65) CSNK2A2CSNK2A1NPY5RCHRNA3KCNH2
SCHEMBL1664964 0.79 CSNK2A2 (0.88) CSNK2A2CSNK2A1NPY5RMEN1LMNA
SCHEMBL7002169 0.78 NPY5R (0.67) CSNK2A2CSNK2A1NPY5RMEN1LMNA
SCHEMBL7000363 0.78 NPY5R (1.00) CSNK2A2CSNK2A1NPY5RCHRNA3KCNH2
SCHEMBL896838 0.78 CCNA2 (0.62) MEN1KMT2AALDH1A1GAAHTT
SCHEMBL6958633 0.77 CSNK2A2 (0.56) CSNK2A2CSNK2A1NPY5RMEN1LMNA
Iodide SCHEMBL2378107 0.77 CSNK2A2 (0.62) CSNK2A2CSNK2A1NPY5RMAPK1TNIK
SCHEMBL6996444 0.76 NPY5R (0.86) CSNK2A2CSNK2A1NPY5RMEN1LMNA
SCHEMBL6956624 0.76 NPY5R (0.58) CSNK2A2CSNK2A1NPY5RKDRFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0955293-B1 UREA DERIVATIVES BANYU PHARMA CO LTD (JP) 2003-03-19 EP disclosed
US-6043246-A Urea derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-03-28 US disclosed
EP-0955293-A1 NOVEL UREA DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-11-10 EP disclosed