SCHEMBL5090168

SCHEMBL5090168

Nc1ccc(C=CC(=O)c2cc3ccccc3nc2N2CCOCC2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.62
PPARA Q07869 2/20 0.62
SCN10A Q9Y5Y9 1/20 0.49
MAPT P10636 7/20 0.48
KMT2A Q03164 5/20 0.48
ALDH1A1 P00352 5/20 0.48
MEN1 O00255 3/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MAOB P27338 2/20 0.46
KDM4E B2RXH2 4/20 0.45
PKM P14618 2/20 0.45
POLB P06746 1/20 0.44
MAPK1 P28482 2/20 0.43
GAA P10253 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ATM Q13315 1/20 0.43
CYP3A4 P08684 2/20 0.43

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
SCHEMBL5090175 0.81 MAPT (0.53) PPARDPPARASCN10AMAPTKMT2A
SCHEMBL2912914 0.78 SCN10A (0.59) PPARDPPARASCN10AMAPTKMT2A
SCHEMBL22263424 0.77 PPARA (1.00) PPARDPPARASCN10AKMT2AALDH1A1
SCHEMBL22263425 0.77 PPARA (1.00) PPARDPPARASCN10AKMT2AALDH1A1
SCHEMBL4220258 0.77 PKM (0.60) PPARDPPARASCN10AMAPTKMT2A
SCHEMBL5096140 0.76 MEN1 (0.47) PPARDPPARAMAPTKMT2AALDH1A1
SCHEMBL18412896 0.76 SCN10A (0.59) PPARDPPARASCN10AMAPTKMT2A
SCHEMBL22278941 0.75 PPARA (0.83) PPARDPPARASCN10AMAPTKMT2A
SCHEMBL18395107 0.73 SCN10A (0.56) PPARDPPARASCN10AMAPTKMT2A
SCHEMBL5096124 0.73 MAPT (0.53) MAPTKMT2AALDH1A1MEN1L3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080207608-A1 2-Propene-1-Ones As Hsp 70 Inducers TORRENT PHARMACEUTICALS LTD. (IN) 2008-08-28 US disclosed
EP-1748987-A2 2-PROPENE-1-ONES AS HSP 70 INDUCERS Torrent Pharmaceuticals Ltd (IN) 2007-02-07 EP disclosed
WO-2005097746-A2 2-PROPENE-1-ONES AS HSP 70 INDUCERS TORRENT PHARMACEUTICALS LTD (IN) 2005-10-20 WO 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-20080207608-A1 2-Propene-1-Ones As Hsp 70 Inducers HSPB1, HSF1, HSPE1 PPARD 2877/4885PPARA 2471/4885SCN10A 1204/4885

“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.