SCHEMBL6553965

SCHEMBL6553965

CC(=O)OOc1ccc(S(=O)(=O)c2ccc(C[C@@H](C)N)cc2)cc1F

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PPARG P37231 2/20 0.36
PPARA Q07869 2/20 0.36
TAAR1 Q96RJ0 3/20 0.35
SLC6A2 P23975 2/20 0.35
SLC6A3 Q01959 1/20 0.35
CARM1 Q86X55 1/20 0.35
PRMT6 Q96LA8 1/20 0.35

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
SCHEMBL6553968 0.88 CYP4F2 (0.42) NAMPTMEN1KMT2ATAAR1SLC6A2
SCHEMBL6553061 0.87 KMT2A (0.38) NAMPTKMT2ATAAR1SLC6A2
SCHEMBL6554091 0.86 PNMT (0.39) NAMPTTAAR1SLC6A2SLC6A3
SCHEMBL6554019 0.86 HTR6 (0.48) NAMPT
SCHEMBL6552874 0.82 ESR1 (0.38) NAMPT
SCHEMBL6540375 0.82 PTPN1 (0.45) PPARGPPARA
SCHEMBL6552726 0.82 SLC6A4 (0.46) TAAR1SLC6A2SLC6A3
SCHEMBL6554514 0.81 MTNR1B (0.41) NAMPTTAAR1SLC6A2
SCHEMBL6553063 0.78 KMT2A (0.47) KMT2ATAAR1SLC6A2
SCHEMBL6554227 0.77 ADRB3 (0.56)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1389185-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-02-18 EP disclosed
WO-2002094770-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-28 WO disclosed