SCHEMBL6955897

SCHEMBL6955897

O=C(Nc1cc(-c2ccccc2Cl)[nH]n1)N1CCN(c2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 3/20 0.55
FAAH O00519 1/20 0.52
MAPT P10636 3/20 0.50
HTT P42858 2/20 0.50
KMT2A Q03164 2/20 0.50
POLB P06746 2/20 0.50
MEN1 O00255 1/20 0.50
HCRTR1 O43613 1/20 0.50
USP2 O75604 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
MAPK1 P28482 1/20 0.50
CYP2C19 P33261 1/20 0.50
LMNA P02545 3/20 0.48
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL6956462 0.87 FAAH (0.52) NPY5RFAAHMAPTHTTKMT2A
SCHEMBL6961788 0.85 FAAH (0.69) NPY5RFAAHMAPTHTTKMT2A
SCHEMBL6960814 0.85 FAAH (0.56) NPY5RFAAHMAPTHTTKMT2A
SCHEMBL6968019 0.85 NPY5R (0.67) NPY5RFAAHMAPTHTTKMT2A
SCHEMBL6965700 0.84 CHRNA3 (0.55) NPY5RFAAHMAPTHTTKMT2A
SCHEMBL6959291 0.83 FAAH (0.66) NPY5RFAAHMAPTHTTKMT2A
SCHEMBL6963922 0.83 FAAH (0.58) NPY5RFAAHMAPTHTTKMT2A
SCHEMBL6957653 0.81 FAAH (0.61) NPY5RFAAHMAPTHTTKMT2A
SCHEMBL6952892 0.80 FAAH (0.60) NPY5RFAAHMAPTHTTKMT2A
SCHEMBL6960345 0.80 FAAH (0.60) NPY5RFAAHMAPTHTTKMT2A

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