SCHEMBL14067671

SCHEMBL14067671

CN1C=C(C(=O)NCCO)Cc2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
MTNR1A P48039 2/20 0.39
MTNR1B P49286 2/20 0.39
KDM4E B2RXH2 4/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NOTUM Q6P988 1/20 0.36
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
DRD2 P14416 1/20 0.35
DRD3 P35462 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
SCHEMBL9011282 0.78 NOTUM (0.45) LMNANPC1RAB9AL3MBTL1CYP3A4
SCHEMBL4767870 0.76 NOTUM (0.44) KDM4EL3MBTL1CYP3A4ALDH1A1MAPT
SCHEMBL14067698 0.75 NOTUM (0.42) KDM4ENPC1L3MBTL1CYP3A4ALDH1A1
SCHEMBL12857207 0.75 NOTUM (0.42) KDM4ENPC1RAB9AL3MBTL1CYP3A4
SCHEMBL12426331 0.72 ACHE (0.57) LMNAKDM4ENPC1RAB9ACYP3A4
SCHEMBL24247562 0.66 KDM4E (0.47) LMNAKDM4EL3MBTL1ALDH1A1MAPT
SCHEMBL9551608 0.66 NOTUM (0.41) LMNAKDM4ERAB9AL3MBTL1CYP3A4
SCHEMBL26366444 0.65 ALDH1A1 (0.41) LMNAKDM4ERAB9ACYP3A4MAPK1
SCHEMBL14067740 0.65 KDM4E (0.41) LMNAMTNR1AMTNR1BKDM4EL3MBTL1
SCHEMBL9011159 0.65 RAB9A (0.56) NPC1RAB9AL3MBTL1HDAC6

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 LMNA 4686/4885MTNR1A 2716/4885MTNR1B 2514/4885

“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.