SCHEMBL10114738

SCHEMBL10114738

Cc1cc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)cc(C)c1N1C[C@@H](C)O[C@@H](C)C1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
EPHX2 P34913 2/20 0.36
GRIA2 P42262 2/20 0.36
MAPT P10636 1/20 0.35
GSK3B P49841 1/20 0.35
LMNA P02545 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
JAK1 P23458 1/20 0.35
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL12882326 1.00 MEN1 (0.38) MEN1KMT2APOLBSMN1; SMN2EPHX2
SCHEMBL13204288 0.93 SHMT2 (0.36) MEN1KMT2APOLBSMN1; SMN2EPHX2
SCHEMBL10114772 0.93 SHMT2 (0.36) MEN1KMT2APOLBSMN1; SMN2EPHX2
SCHEMBL10114758 0.89 SHMT2 (0.39) MEN1KMT2APOLBSMN1; SMN2GRIA2
SCHEMBL14424176 0.89 SHMT2 (0.39) MEN1KMT2APOLBSMN1; SMN2GRIA2
SCHEMBL10114386 0.87 KDM4E (0.40) MEN1KMT2ASMN1; SMN2GRIA2MAPT
SCHEMBL10114735 0.87 KDM4E (0.40) MEN1KMT2ASMN1; SMN2GRIA2MAPT
SCHEMBL10115609 0.85 LMNA (0.37) KMT2APOLBSMN1; SMN2MAPTLMNA
SCHEMBL13204314 0.84 MAPT (0.49) MEN1KMT2ASMN1; SMN2EPHX2MAPT
SCHEMBL10113964 0.84 MAPT (0.49) MEN1KMT2ASMN1; SMN2EPHX2MAPT

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 5 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-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-7265130-B2 NPY Y5 antagonist SHIONOGI & CO., LTD. (JP) 2007-09-04 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 (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-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R MEN1 2932/4885KMT2A 2768/4885POLB 4751/4885

“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.