SCHEMBL21963795

SCHEMBL21963795

CC(C)C(=O)N1C[C@@H]2CC1CN2C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.46
CHRNB2 P17787 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA4 P43681 1/20 0.41
CHRNB3 Q05901 1/20 0.41
CHRNA6 Q15825 1/20 0.41
DPP4 P27487 4/20 0.33
DPP8 Q6V1X1 4/20 0.33
DPP9 Q86TI2 4/20 0.33

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
SCHEMBL21963809 1.00 PIK3CD (0.46) PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL22916981 0.92 PIK3CD (0.52) PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL25514814 0.92 PIK3CD (0.52) PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL23011816 0.84 PIK3CD (0.46) PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL5036242 0.82 ATM (0.32)
SCHEMBL18347997 0.82 PIK3CD (0.44) PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL14376293 0.82 PIK3CD (0.44) PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL18347996 0.82 PIK3CD (0.44) PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL19869628 0.82 PIK3CD (0.44) PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL15196705 0.81 PIK3CD (0.43) PIK3CDCHRNB2CHRNA3CHRNA4CHRNB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220017516-A1 LOX INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2022-01-20 US disclosed
EP-3880664-A1 LOX INHIBITORS The Institute of Cancer Research: Royal Cancer Hospital (GB) 2021-09-22 EP disclosed
CN-113365984-A LOX inhibitors 癌症研究协会皇家癌症医院 2021-09-07 CN disclosed
WO-2020099886-A1 LOX INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2020-05-22 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-20220017516-A1 LOX INHIBITORS LOXL1, LOX, LOXL2 PIK3CD 2549/4885CHRNB2 3882/4885CHRNA3 4302/4885

“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.