SCHEMBL10134200

SCHEMBL10134200

CC1CN(C(=O)c2ccc(NC(=O)N3CCC(NS(=O)(=O)C(C)C)CC3)cc2)CC(C)O1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 4/20 0.57
CRHBP P24387 3/20 0.48
CRHR2 Q13324 3/20 0.48
KMT2A Q03164 6/20 0.48
ALDH1A1 P00352 2/20 0.47
HPGD P15428 1/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.42
ATM Q13315 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 1/20 0.42

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
SCHEMBL10116074 1.00 NAMPT (0.57) NAMPTCRHBPCRHR2KMT2AALDH1A1
SCHEMBL10116076 0.89 HSD17B10 (0.51) NAMPTKMT2ANPC1LMNAATM
SCHEMBL10134197 0.89 HSD17B10 (0.51) NAMPTKMT2ANPC1LMNAATM
SCHEMBL10115911 0.87 MAPT (0.48) NAMPTKMT2AALDH1A1NPC1LMNA
SCHEMBL10115860 0.87 MAPT (0.48) NAMPTKMT2AALDH1A1NPC1LMNA
SCHEMBL12882027 0.86 NAMPT (0.57) NAMPTCRHBPCRHR2KMT2AALDH1A1
SCHEMBL10133501 0.86 NAMPT (0.49) NAMPTCRHBPCRHR2KMT2AALDH1A1
SCHEMBL10115730 0.86 NAMPT (0.57) NAMPTCRHBPCRHR2KMT2AALDH1A1
SCHEMBL10114882 0.86 NAMPT (0.49) NAMPTCRHBPCRHR2KMT2AALDH1A1
SCHEMBL14424644 0.86 NAMPT (0.49) NAMPTCRHBPCRHR2KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8115027-B2 NPY Y5 antagonist SHIONOGI & CO., LTD. (JP) 2012-02-14 US disclosed
US-20110039802-A1 NPY Y5 ANTAGONIST KAWANISHI YASUYUKI 2011-02-17 US disclosed
US-20100292500-A1 NPY Y5 ANTAGONIST KAWANISHI YASUYUKI 2010-11-18 US disclosed
US-7781461-B2 NPY Y5 antagonist KAWANISHI YASUYUKI 2010-08-24 US 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 (2 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-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R NAMPT 2350/4885CRHBP 256/4885CRHR2 13/4885
US-20110039802-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R NAMPT 2832/4885CRHBP 247/4885CRHR2 12/4885

“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.