SCHEMBL21144296

SCHEMBL21144296

NC(=O)OC1C2CNCC21

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.32
NOS2 P35228 1/20 0.32
CHRNB2 P17787 2/20 0.31
CHRNB4 P30926 2/20 0.31
CHRNA3 P32297 2/20 0.31
CHRNA4 P43681 2/20 0.31
CHRNA7 P36544 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
CYP2D6 P10635 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
SCHEMBL26099346 1.00 ATM (0.32) ATMNOS2CHRNB2CHRNB4CHRNA3
SCHEMBL26099348 1.00 ATM (0.32) ATMNOS2CHRNB2CHRNB4CHRNA3
SCHEMBL26918754 0.78 CHRNB2 (0.30) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL22235569 0.77 CHRNB2 (0.42) ATMNOS2CHRNB2CHRNB4CHRNA3
SCHEMBL13778882 0.75
Hydrochloric Acid SCHEMBL31099330 0.74 CYP2D6 (0.37) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL2437352 0.73 EPHX1 (0.34) ATM
Hydrochloric Acid SCHEMBL19717784 0.73
SCHEMBL29244684 0.71 IRAK4 (0.40) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL23364994 0.71 CHRNB2 (0.38) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7

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
CN-115916765-B Pyridine or pyrimidine derivative and preparation method and application thereof 浙江海正药业股份有限公司 2025-04-18 CN disclosed
CN-118786118-A Antimicrobial compounds and methods 库扎环球有限责任公司 2024-10-15 CN disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 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 (2 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-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 ATM 3611/4885NOS2 2703/4885CHRNB2 504/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 ATM 3611/4885NOS2 2703/4885CHRNB2 504/4885

“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.