SCHEMBL10116283

SCHEMBL10116283

Cc1cc(NC(=O)c2ccc(NS(=O)(=O)C(C)(C)C)cc2)cc(C(=O)NC(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.46
LMNA P02545 5/20 0.43
KDM4E B2RXH2 3/20 0.43
HTT P42858 5/20 0.42
MAPT P10636 6/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 2/20 0.41
MEN1 O00255 7/20 0.41
KMT2A Q03164 7/20 0.41
ALDH1A1 P00352 2/20 0.41
GAA P10253 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL10114588 0.88 LMNA (0.53) ACLYLMNAKDM4EHTTMAPT
SCHEMBL10116611 0.86 ACLY (0.45) ACLYLMNAKDM4EHTTMAPT
SCHEMBL10114497 0.85 HPGD (0.56) ACLYLMNAKDM4EHTTMAPT
SCHEMBL10116350 0.85 ACLY (0.47) ACLYLMNAKDM4EHTTMAPT
SCHEMBL17090059 0.84 LMNA (0.40) ACLYLMNAMAPTALDH1A1
SCHEMBL10116414 0.82 MAPT (0.49) ACLYLMNAKDM4EHTTMAPT
SCHEMBL10116346 0.81 ALDH1A1 (0.41) ACLYLMNAKDM4EMAPTSMN1; SMN2
SCHEMBL10116404 0.79 ACLY (0.42) ACLYLMNAKDM4EHTTMAPT
SCHEMBL10116183 0.79 NPC1 (0.67) LMNAKDM4EHTTMAPTSMN1; SMN2
SCHEMBL10116240 0.78 MEN1 (0.55) LMNAKDM4EHTTMAPTSMN1; SMN2

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 6 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-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
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 (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-20070015762-A1 NPY Y5 antagonist NPY5R, NPY1R, NPY2R ACLY 3436/4885LMNA 1925/4885KDM4E 1668/4885
US-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R ACLY 3437/4885LMNA 2068/4885KDM4E 1627/4885

“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.