SCHEMBL6045233

SCHEMBL6045233

[CH2][C@H]1CCCN(C(N)=O)C1=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.33
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MAPT P10636 1/20 0.31
APEX1 P27695 1/20 0.31
ALDH1A1 P00352 2/20 0.31
ENO1 P06733 1/20 0.31
ACE P12821 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL6045399 1.00 HSD17B10 (0.33) HSD17B10CYP3A4TSHRTDP1MAPT
SCHEMBL6044945 0.88 CYP3A4 (0.33) CYP3A4TSHRTDP1MAPTAPEX1
SCHEMBL6044863 0.88 CYP3A4 (0.33) CYP3A4TSHRTDP1MAPTAPEX1
SCHEMBL4703842 0.77 HSD17B10 (0.36) HSD17B10ALDH1A1
SCHEMBL1114602 0.73 CYP3A4 (0.44) CYP3A4TSHRTDP1MAPTAPEX1
SCHEMBL6204993 0.70 HTT (0.36) ALDH1A1HTT
SCHEMBL6205359 0.70 HTT (0.36) ALDH1A1HTT
SCHEMBL6205391 0.69 HTT (0.36) ALDH1A1HTT
SCHEMBL6205057 0.69 ALDH1A1 (0.37) CYP3A4ALDH1A1HTT
SCHEMBL8779711 0.68 CYP3A4 (0.33) CYP3A4TSHRTDP1MAPTAPEX1

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-20060154926-A1 Methods of treating alzheimer's disease using aryl alkanoic acid amides ELAN PHARMACEUTICALS, INC. 2006-07-13 US claimed
EP-0678503-B1 Delta-amino-gamma-hydroxy-omega-aryl alkanoic acid amides with enzyme especially renin inhibiting activities NOVARTIS AG (CH) 1999-09-01 EP claimed
US-20060154926-A1 Methods of treating alzheimer's disease using aryl alkanoic acid amides ELAN PHARMACEUTICALS, INC. 2006-07-13 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 (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-20060154926-A1 Methods of treating alzheimer's disease using aryl alkanoic acid amides BACE1, APP, PSEN1 HSD17B10 580/4885CYP3A4 1974/4885TSHR 876/4885

“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.