SCHEMBL14067740

SCHEMBL14067740

CN1Cc2ccccc2C=C1C(=O)NCCO

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
LMNA P02545 1/20 0.40
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
TMEM97 Q5BJF2 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
NAMPT P43490 8/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
LIPG Q9Y5X9 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MMP13 P45452 1/20 0.36
BRD4 O60885 1/20 0.35

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
SCHEMBL7491630 0.76 MAOA (0.44) KDM4EMTNR1AMTNR1BNAMPTL3MBTL1
SCHEMBL14067671 0.65 LMNA (0.40) KDM4ELMNAMTNR1AMTNR1BALDH1A1
SCHEMBL23659145 0.64 MAPT (0.39) LMNAMTNR1AMTNR1BMAPTL3MBTL1
SCHEMBL1048905 0.64 DRD3 (0.43) ALDH1A1MAPTBRD4
SCHEMBL26840284 0.63 DRD3 (0.38) MAPTBRD4
SCHEMBL8894839 0.63 ALDH1A1 (0.62) KDM4ELMNAALDH1A1MAPTCASP1
SCHEMBL12913023 0.63 KDM4E (0.52) KDM4ENAMPTALDH1A1
Iodide SCHEMBL7251057 0.62 DRD3 (0.42) ALDH1A1MAPTBRD4
SCHEMBL23346691 0.62 DRD3 (0.40) MAPTBRD4
SCHEMBL29174081 0.62 TSHR (0.40) KDM4ENAMPTMAPT

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-20080227806-A1 Novel Drugs for Dementia AMERICAN LIFE SCIENCE PHARMACEUTICALS (US) 2008-09-18 US disclosed
US-20080227806-A1 Novel Drugs for Dementia AMERICAN LIFE SCIENCE PHARMACEUTICALS (US) 2008-09-18 US disclosed
WO-2007038772-A1 NOVEL DRUGS FOR DEMENTIA AMERICAN LIFE SCIENCE PHARMACEUTICALS (US) 2007-04-05 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-20080227806-A1 Novel Drugs for Dementia CTSS, PRSS1, CBS KDM4E 3000/4885LMNA 4686/4885MTNR1A 2716/4885

“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.