SCHEMBL6959757

SCHEMBL6959757

COc1ccc(-c2cc(NC(=O)N3CCN(c4ccccc4)CC3)n[nH]2)cc1N(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.50
FAAH O00519 1/20 0.49
HTR1A P08908 3/20 0.48
HTR1D P28221 3/20 0.48
HTR1B P28222 3/20 0.48
NPY5R Q15761 4/20 0.47
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47
HTR6 P50406 1/20 0.47
FLT3 P36888 9/20 0.47
KDR P35968 3/20 0.45
AURKA O14965 1/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
PKM P14618 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.45
FLT1 P17948 2/20 0.44
NTRK3 Q16288 1/20 0.44
NTRK2 Q16620 1/20 0.44

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
SCHEMBL6961253 0.90 NPY5R (0.58) RBP4FAAHHTR1AHTR1DHTR1B
SCHEMBL6956771 0.84 FAAH (0.57) FAAHNPY5RFLT3KDRAURKA
SCHEMBL6956624 0.84 NPY5R (0.58) FAAHNPY5RFLT3KDRAURKA
SCHEMBL6952931 0.82 FAAH (0.55) FAAHNPY5RFLT3KDRAURKA
SCHEMBL6966880 0.82 FAAH (0.55) FAAHNPY5RFLT3KDRMEN1
SCHEMBL6965700 0.82 CHRNA3 (0.55) RBP4FAAHHTR1AHTR1DHTR1B
SCHEMBL6959291 0.81 FAAH (0.66) FAAHNPY5RFLT3KDRAURKA
SCHEMBL6961788 0.81 FAAH (0.69) FAAHNPY5RFLT3KDRAURKA
SCHEMBL6959277 0.81 RBP4 (0.53) RBP4NPY5RFLT3MEN1LMNA
SCHEMBL6960345 0.81 FAAH (0.60) FAAHNPY5RFLT3KDRAURKA

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