SCHEMBL3000878

SCHEMBL3000878

CCOC(=O)C1CNCC(c2ccccc2)C1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
PKM P14618 1/20 0.50
TSHR P16473 1/20 0.47
RAB9A P51151 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 2/20 0.43
TP53 P04637 1/20 0.43
DHFR P00374 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ADORA3 P0DMS8 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL360491 0.82 TSHR (0.50) MAPTPKMTSHRRAB9AMEN1
SCHEMBL5896950 0.80 TLR4 (0.49) MAPTPKMTSHRRAB9AMEN1
SCHEMBL27786395 0.79 CYP3A4 (0.41) MAPTMEN1KMT2ACYP2D6ALDH1A1
SCHEMBL4768563 0.77 MEN1 (0.48) MAPTPKMTSHRRAB9AMEN1
SCHEMBL512197 0.77 TSHR (0.46) TSHRRAB9AMEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL1617512 0.76 TSHR (0.45) MAPTPKMTSHRRAB9AMEN1
SCHEMBL18618382 0.75 MAPT (0.43) MAPTPKMRAB9AMEN1KMT2A
Hydrochloric Acid SCHEMBL18586124 0.74 MAPT (0.42) MAPTPKMRAB9AMEN1KMT2A
SCHEMBL30377419 0.73 PKM (0.46) MAPTPKMTSHRRAB9AMEN1
SCHEMBL3552839 0.73 MAPT (0.76) MAPTPKMTSHRMEN1KMT2A

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-20100190824-A1 Novel Substituted Piperidones as HSP Inducers TORRENT PHARMACEUTICALS LTD. (IN) 2010-07-29 US disclosed
EP-2178835-A1 NOVEL SUBSTITUTED PIPERIDONES AS HSP INDUCERS Torrent Pharmaceuticals Ltd (IN) 2010-04-28 EP disclosed
WO-2009004650-A1 NOVEL SUBSTITUTED PIPERIDONES AS HSP INDUCERS TORRENT PHARMACEUTICALS LTD. (IN) 2009-01-08 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-20100190824-A1 Novel Substituted Piperidones as HSP Inducers HSF1, HSPA4, HSPA5 MAPT 40/4885PKM 1183/4885TSHR 2449/4885

“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.