SCHEMBL10113699

SCHEMBL10113699

CCOC(=O)C1CCN(c2ccc(NC(=O)CCCCNS(=O)(=O)C(C)C)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.47
MAPT P10636 3/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 3/20 0.46
HPGD P15428 2/20 0.46
ADRB2 P07550 1/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 1/20 0.46
PTK2 Q05397 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TP53 P04637 1/20 0.45
LGMN Q99538 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL13564807 0.88 MAPT (0.49) LMNASMN1; SMN2MAPTALDH1A1HPGD
SCHEMBL10113409 0.87 LMNA (0.52) LMNASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10113690 0.83 GAA (0.59) LMNASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10113674 0.82 SMN1; SMN2 (0.59) LMNASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10113756 0.82 MCHR1 (0.46) LMNASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10113669 0.81 ALDH1A1 (0.59) SMN1; SMN2MAPTKDM4EALDH1A1KMT2A
SCHEMBL10113695 0.81 MAPT (0.55) LMNASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10113693 0.81 KDM4E (0.54) LMNASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10113698 0.81 SMN1; SMN2 (0.48) LMNASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10113735 0.81 NAMPT (0.46) LMNASMN1; SMN2MAPTKDM4EALDH1A1

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 11 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-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-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
US-7781461-B2 NPY Y5 antagonist KAWANISHI YASUYUKI 2010-08-24 US disclosed
US-7265130-B2 NPY Y5 antagonist SHIONOGI & CO., LTD. (JP) 2007-09-04 US disclosed
US-7265130-B2 NPY Y5 antagonist SHIONOGI & CO., LTD. (JP) 2007-09-04 US disclosed
US-20070015762-A1 NPY Y5 antagonist KAWANISHI YASUYUKI 2007-01-18 US disclosed
US-20070015762-A1 NPY Y5 antagonist KAWANISHI YASUYUKI 2007-01-18 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 (3 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-20070015762-A1 NPY Y5 antagonist NPY5R, NPY1R, NPY2R LMNA 1925/4885SMN1; SMN2 2213/4885MAPT 3602/4885
US-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R LMNA 2068/4885SMN1; SMN2 2197/4885MAPT 3367/4885
US-20110039802-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R LMNA 1857/4885SMN1; SMN2 2251/4885MAPT 3683/4885

“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.