SCHEMBL2879517

SCHEMBL2879517

CC(C)(C)S(=O)(=O)N[C@H]1CC[C@H](c2nc3nc(-c4ccc(F)cc4)ncc3[nH]2)CC1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.37
BTK Q06187 1/20 0.34
KMT2A Q03164 1/20 0.34
SGK1 O00141 2/20 0.33
CSNK1A1 P48729 1/20 0.33
CSNK1D P48730 1/20 0.33
RPS6KA3 P51812 1/20 0.33
BRD4 O60885 1/20 0.33
TDO2 P48775 1/20 0.33
MAP2K7 O14733 1/20 0.32
MAP2K4 P45985 1/20 0.32
KIT P10721 3/20 0.32
GRIA2 P42262 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
BRAF P15056 1/20 0.32

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
SCHEMBL2879013 1.00 NPY5R (0.37) NPY5RBTKKMT2ASGK1CSNK1A1
SCHEMBL2879012 1.00 NPY5R (0.37) NPY5RBTKKMT2ASGK1CSNK1A1
SCHEMBL2879071 0.90 HTR2B (0.39) NPY5RBRD4
SCHEMBL2884478 0.90 HTR2B (0.39) NPY5RBRD4
SCHEMBL2879075 0.90 HTR2B (0.39) NPY5RBRD4
SCHEMBL2879010 0.85 NPY5R (0.37) NPY5RBTKKMT2ASGK1CSNK1A1
SCHEMBL2879515 0.85 NPY5R (0.37) NPY5RBTKKMT2ASGK1CSNK1A1
SCHEMBL2881783 0.85 NPY5R (0.36) NPY5RBTKSGK1
SCHEMBL2879017 0.85 NPY5R (0.36) NPY5RBTKSGK1
SCHEMBL2879019 0.85 NPY5R (0.36) NPY5RBTKSGK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7691860-B2 Sulfonamide derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-04-06 US claimed
CN-100567270-C Sulfone amide derivative BANYU PHARMA CO LTD (JP) 2009-12-09 CN claimed
US-20080161326-A1 Novel Sulfone Amide Amide Derivatives MSD K.K. (JP) 2008-07-03 US claimed
CN-1922155-A Novel Sulfonamide Derivatives BANYU PHARMA CO LTD (JP) 2007-02-28 CN claimed
EP-1719765-A1 NOVEL SULFONE AMIDE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-08 EP claimed
US-7691860-B2 Sulfonamide derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-04-06 US disclosed
CN-100567270-C Sulfone amide derivative BANYU PHARMA CO LTD (JP) 2009-12-09 CN disclosed
US-20080161326-A1 Novel Sulfone Amide Amide Derivatives MSD K.K. (JP) 2008-07-03 US disclosed
CN-1922155-A Novel Sulfonamide Derivatives BANYU PHARMA CO LTD (JP) 2007-02-28 CN disclosed
EP-1719765-A1 NOVEL SULFONE AMIDE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-08 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080161326-A1 Novel Sulfone Amide Amide Derivatives NPY1R, NPY2R, NPY5R NPY5R 3/4885BTK 1120/4885KMT2A 1730/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.