SCHEMBL6966880

SCHEMBL6966880

COc1cccc(-c2cc(NC(=O)N3CCN(c4ccccc4)CC3)n[nH]2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.55
KCNH2 Q12809 1/20 0.55
KMT2A Q03164 2/20 0.54
GAA P10253 1/20 0.54
FLT3 P36888 5/20 0.53
KIT P10721 1/20 0.51
FLT1 P17948 2/20 0.51
KDR P35968 2/20 0.51
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
CA12 O43570 2/20 0.49
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
CA9 Q16790 2/20 0.49
NPY5R Q15761 2/20 0.49
MAPT P10636 2/20 0.49
MAPK1 P28482 2/20 0.49
HTT P42858 2/20 0.49
MEN1 O00255 1/20 0.48
HCRTR1 O43613 1/20 0.48

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
SCHEMBL6956624 0.90 NPY5R (0.58) FAAHKCNH2KMT2AFLT3FLT1
SCHEMBL6961788 0.88 FAAH (0.69) FAAHKMT2AFLT3FLT1KDR
SCHEMBL6955329 0.87 FAAH (0.58) FAAHKMT2AFLT3FLT1KDR
SCHEMBL6954187 0.87 FLT3 (0.55) FAAHKCNH2FLT3FLT1KDR
SCHEMBL6961253 0.86 NPY5R (0.58) FAAHKMT2AFLT3KDRALDH1A1
SCHEMBL6959291 0.85 FAAH (0.66) FAAHKMT2AFLT3FLT1KDR
SCHEMBL6959800 0.85 FAAH (0.58) FAAHKMT2AFLT3FLT1KDR
SCHEMBL6963922 0.85 FAAH (0.58) FAAHKMT2AFLT3FLT1KDR
SCHEMBL6952931 0.84 FAAH (0.55) FAAHKMT2AFLT3FLT1KDR
SCHEMBL6961328 0.83 MAPT (0.56) FAAHKCNH2KMT2AGAAALDH1A1

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 6 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 claimed
US-6043246-A Urea derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-03-28 US claimed
EP-0955293-A1 NOVEL UREA DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-11-10 EP claimed
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