SCHEMBL10116620

SCHEMBL10116620

Cc1cc(N2CC=CC2)ccc1NC(=O)c1ccc(NS(=O)(=O)C(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.44
MAPT P10636 5/20 0.43
LMNA P02545 3/20 0.43
ALDH1A1 P00352 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
HTT P42858 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
THRB P10828 1/20 0.40
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL10116489 0.87 THRB (0.43) FLT3MAPTLMNAALDH1A1L3MBTL1
SCHEMBL10116579 0.85 MAPT (0.51) FLT3MAPTLMNAALDH1A1L3MBTL1
SCHEMBL10116317 0.85 MAPT (0.48) MAPTLMNAALDH1A1L3MBTL1MEN1
SCHEMBL10116585 0.80 ALDH1A1 (0.53) MAPTLMNAALDH1A1L3MBTL1MEN1
SCHEMBL10116728 0.80 MAPT (0.46) MAPTLMNAALDH1A1L3MBTL1MEN1
SCHEMBL14424412 0.80 MAPT (0.43) MAPTLMNAALDH1A1L3MBTL1MEN1
SCHEMBL11936110 0.79 PARP1 (0.37) MAPTLMNAALDH1A1L3MBTL1MEN1
SCHEMBL10134215 0.79 THRB (0.40) FLT3MAPTLMNAALDH1A1L3MBTL1
SCHEMBL10116596 0.79 THRB (0.40) FLT3MAPTLMNAALDH1A1L3MBTL1
SCHEMBL10116486 0.77 KDM4E (0.41) FLT3MAPTLMNAKMT2ATHRB

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 10 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-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 FLT3 831/4885MAPT 3602/4885LMNA 1925/4885
US-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R FLT3 864/4885MAPT 3367/4885LMNA 2068/4885
US-20110039802-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R FLT3 814/4885MAPT 3683/4885LMNA 1857/4885

“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.