SCHEMBL13204309

SCHEMBL13204309

COc1ccc(NC(=O)[C@H]2CC[C@H](NS(=O)(=O)C(C)C)CC2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.49
SMN1; SMN2 Q16637 4/20 0.47
HPGD P15428 1/20 0.47
LMNA P02545 2/20 0.45
KMT2A Q03164 1/20 0.45
HTT P42858 1/20 0.45
ACLY P53396 1/20 0.44
ALOX15 P16050 1/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP2C19 P33261 1/20 0.43
MALT1 Q9UDY8 1/20 0.42
ACHE P22303 1/20 0.42
BACE1 P56817 1/20 0.42
TP53 P04637 1/20 0.42
MAP2K1 Q02750 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
SCHEMBL10114755 1.00 POLB (0.49) POLBSMN1; SMN2HPGDLMNAKMT2A
SCHEMBL10114754 0.90 POLB (0.58) POLBSMN1; SMN2LMNAKMT2AALOX15
SCHEMBL13204304 0.90 POLB (0.58) POLBSMN1; SMN2LMNAKMT2AALOX15
SCHEMBL10114886 0.88 MAPT (0.46) SMN1; SMN2HPGDLMNAKMT2AHTT
SCHEMBL14424189 0.88 MAPT (0.46) SMN1; SMN2HPGDLMNAKMT2AHTT
SCHEMBL13204311 0.87 SMN1; SMN2 (0.62) SMN1; SMN2HPGDACLYALDH1A1MALT1
SCHEMBL10114736 0.87 SMN1; SMN2 (0.62) SMN1; SMN2HPGDACLYALDH1A1MALT1
SCHEMBL14424129 0.86 MAPT (0.48) SMN1; SMN2LMNAKMT2AALDH1A1MAPT
SCHEMBL12881991 0.86 MAPT (0.48) SMN1; SMN2LMNAKMT2AALDH1A1MAPT
SCHEMBL10133752 0.85 NPY5R (0.51) POLBSMN1; SMN2HPGDLMNAKMT2A

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-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 (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-20070015762-A1 NPY Y5 antagonist NPY5R, NPY1R, NPY2R POLB 4727/4885SMN1; SMN2 2213/4885HPGD 3487/4885

“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.