SCHEMBL6347374

SCHEMBL6347374

CC(C)(C)OC(=O)N1CCCCC1CCNS(=O)(=O)c1cccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 13/20 0.51
PREP P48147 1/20 0.48
NPY5R Q15761 5/20 0.45
NPY1R P25929 3/20 0.44
KDM1A O60341 1/20 0.43

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
SCHEMBL8890529 0.82 TGFBR1 (0.53) NPY5R
SCHEMBL6348344 0.78 SLC6A9 (0.55) SLC6A9PREPNPY5R
SCHEMBL21752762 0.77 DPP4 (0.56) NPY5RKDM1A
SCHEMBL4616003 0.76 SFRP1 (0.64)
SCHEMBL6340184 0.76 ACACB (0.52)
SCHEMBL5164618 0.76 KDM1A (0.51) KDM1A
SCHEMBL8899787 0.75 TGFBR1 (0.64) NPY5RNPY1R
SCHEMBL8899558 0.75 ACKR3 (0.53) SLC6A9NPY5RNPY1R
SCHEMBL11969924 0.75 KDM1A (0.55) KDM1A
SCHEMBL7417144 0.74 KDM1A (0.45) KDM1A

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
US-6878736-B1 Histamine H3 receptor ligands JAMES BLACK FOUNDATION LIMITED (GB) 2005-04-12 US disclosed
EP-1056733-A1 HISTAMINE H3 RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2000-12-06 EP disclosed
WO-1999042458-A1 HISTAMINE H3 RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 1999-08-26 WO disclosed