SCHEMBL7568636

SCHEMBL7568636

O=C(CCc1c(Br)ccc2ccccc12)N1C(=O)OC[C@@H]1Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 4/20 0.43
IDH1 O75874 10/20 0.36
FAAH O00519 1/20 0.35
PPARA Q07869 1/20 0.35
CSNK2B P67870 1/20 0.35
CSNK2A1 P68400 1/20 0.35
EP300 Q09472 1/20 0.34
CARM1 Q86X55 1/20 0.34
IL6ST P40189 1/20 0.33
XIAP P98170 1/20 0.33

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
SCHEMBL7266352 0.83 NAAA (0.46) NAAAIDH1PPARA
SCHEMBL7266343 0.83 NAAA (0.46) NAAAIDH1PPARA
SCHEMBL345276 0.81 NAAA (0.57) NAAAIDH1FAAHPPARA
SCHEMBL345275 0.81 NAAA (0.57) NAAAIDH1FAAHPPARA
SCHEMBL6334745 0.81 NAAA (0.57) NAAAIDH1FAAHPPARA
SCHEMBL6788947 0.80 NAAA (0.51) NAAAFAAHPPARAEP300CARM1
SCHEMBL13368994 0.78 NAAA (0.50) NAAAIDH1FAAHPPARAIL6ST
SCHEMBL2207671 0.78 NAAA (0.53) NAAAIDH1FAAHPPARACSNK2B
SCHEMBL292751 0.78 NAAA (0.53) NAAAIDH1FAAHPPARACSNK2B
SCHEMBL292752 0.78 NAAA (0.53) NAAAIDH1FAAHPPARACSNK2B

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-0798291-B1 NOVEL 1,3-DIALKYLUREA DERIVATIVES SANTEN PHARMACEUTICAL CO LTD (JP) 2002-09-11 EP disclosed
US-5968980-A ENDOPEPTIDASE 24.11 INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1999-10-19 US disclosed
EP-0798291-A1 NOVEL 1,3-DIALKYLUREA DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1997-10-01 EP disclosed