SCHEMBL6965780

SCHEMBL6965780

CCOc1ccc(-c2cc(NC(=O)N3CCN(c4ccccc4)CC3)n[nH]2)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.55
ALDH1A1 P00352 2/20 0.55
MEN1 O00255 1/20 0.55
GAA P10253 1/20 0.55
ALOX12 P18054 1/20 0.55
KMT2A Q03164 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
FAAH O00519 2/20 0.55
NPY5R Q15761 2/20 0.52
FLT3 P36888 10/20 0.51
KDR P35968 6/20 0.51
FLT1 P17948 4/20 0.51
AURKA O14965 3/20 0.50
HDAC1 Q13547 1/20 0.50
ADORA2A P29274 1/20 0.47
ADORA2B P29275 1/20 0.47

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 0.89 NPY5R (0.58) MAPTALDH1A1KMT2AL3MBTL1FAAH
SCHEMBL6959291 0.87 FAAH (0.66) MAPTMEN1KMT2AFAAHNPY5R
SCHEMBL6961788 0.87 FAAH (0.69) MAPTMEN1KMT2AFAAHNPY5R
SCHEMBL6963875 0.86 NPY5R (0.59) MAPTMEN1KMT2AFAAHNPY5R
SCHEMBL6960345 0.86 FAAH (0.60) MAPTMEN1KMT2AFAAHNPY5R
SCHEMBL6954187 0.86 FLT3 (0.55) FAAHNPY5RFLT3KDRFLT1
SCHEMBL6952892 0.84 FAAH (0.60) MAPTMEN1KMT2AFAAHNPY5R
SCHEMBL6968019 0.84 NPY5R (0.67) MAPTMEN1KMT2AFAAHNPY5R
SCHEMBL6956771 0.83 FAAH (0.57) MAPTMEN1KMT2AFAAHNPY5R
SCHEMBL6960758 0.83 FAAH (0.57) MAPTMEN1KMT2AFAAHNPY5R

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