SCHEMBL5514993

SCHEMBL5514993

CCCN([C]=O)c1ccncc1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 12/20 0.42
CHRM5 P08912 1/20 0.40
CHKA P35790 1/20 0.40

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
SCHEMBL6696457 0.84 CHRM5 (0.43) SLC6A2CHRM5CHKA
SCHEMBL709443 0.80 TP53 (0.43)
SCHEMBL571886 0.73 SLC6A2 (0.49) SLC6A2CHRM5CHKA
SCHEMBL8281666 0.71 CHRM5 (0.52) SLC6A2CHRM5CHKA
SCHEMBL1998842 0.70 DRD3 (0.46)
SCHEMBL2000378 0.70 RAB9A (0.33)
SCHEMBL1995895 0.70 CETP (0.31)
SCHEMBL8021770 0.69 SLC6A2 (0.46) SLC6A2CHRM5CHKA
Hydrochloric Acid SCHEMBL5395464 0.69 CHRM5 (0.50) SLC6A2CHRM5CHKA
SCHEMBL489807 0.69 TDP1 (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7223755-B2 Hydroxymorpholinone derivative and medicinal use thereof SENJU PHARMACEUTICAL CO., LTD. (JP) 2007-05-29 US disclosed
US-20050176704-A1 Hydroxymorpholinone derivative and medicinal use thereof SENJU PHARMACEUTICAL CO., LTD. (JP) 2005-08-11 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-20050176704-A1 Hydroxymorpholinone derivative and medicinal use thereof CAPN1, OPRM1, CAPN2 SLC6A2 564/4885CHRM5 1025/4885CHKA 3733/4885

“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.