SCHEMBL10133387

SCHEMBL10133387

CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
USP30 Q70CQ3 1/20 0.42
NPY2R P49146 3/20 0.40
BRAF P15056 1/20 0.40
KDR P35968 1/20 0.40
KDM4E B2RXH2 3/20 0.39
LMNA P02545 1/20 0.39
GSK3B P49841 1/20 0.39
RAB9A P51151 1/20 0.38
GRIA2 P42262 1/20 0.38

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
SCHEMBL10114384 1.00 MAPT (0.48) MAPTMEN1KMT2AUSP30NPY2R
SCHEMBL10114735 0.90 KDM4E (0.40) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL10114386 0.90 KDM4E (0.40) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL10114721 0.89 HPGD (0.48) MAPTMEN1KMT2ANPY2RKDM4E
SCHEMBL13204294 0.89 HPGD (0.48) MAPTMEN1KMT2ANPY2RKDM4E
SCHEMBL10133617 0.89 HPGD (0.48) MAPTMEN1KMT2ANPY2RKDM4E
SCHEMBL10116482 0.89 HPGD (0.48) MAPTMEN1KMT2ANPY2RKDM4E
SCHEMBL10114330 0.88 MAPT (0.49) MAPTMEN1KMT2AUSP30NPY2R
SCHEMBL12882404 0.88 MAPT (0.49) MAPTMEN1KMT2AUSP30NPY2R
SCHEMBL14424176 0.88 SHMT2 (0.39) MAPTMEN1KMT2ABRAFKDR

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 8 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
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-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 MAPT 3602/4885MEN1 2876/4885KMT2A 2912/4885
US-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R MAPT 3367/4885MEN1 2932/4885KMT2A 2768/4885
US-20110039802-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R MAPT 3683/4885MEN1 2926/4885KMT2A 2953/4885

“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.