SCHEMBL4335026

SCHEMBL4335026

CN1C[C@@H]2C[C@H]1CN2C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
VNN1 O95497 1/20 0.37
HSD11B1 P28845 5/20 0.37
CHRM2 P08172 4/20 0.34
CHRM4 P08173 4/20 0.34
CHRM5 P08912 4/20 0.34
CHRM1 P11229 4/20 0.34
CHRM3 P20309 4/20 0.34
GRM5 P41594 1/20 0.33
CHRNA7 P36544 1/20 0.33
KCNH2 Q12809 1/20 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
SCHEMBL27006946 1.00 VNN1 (0.37) VNN1HSD11B1CHRM2CHRM4CHRM5
SCHEMBL610766 1.00 VNN1 (0.37) VNN1HSD11B1CHRM2CHRM4CHRM5
SCHEMBL23404413 1.00 VNN1 (0.37) VNN1HSD11B1CHRM2CHRM4CHRM5
SCHEMBL5036242 0.86 ATM (0.32) HSD11B1
SCHEMBL21884822 0.83 VNN1 (0.37) VNN1HSD11B1CHRM2CHRM4CHRM5
SCHEMBL27384279 0.83 ATM (0.38) VNN1HSD11B1CHRM2CHRM4CHRM5
SCHEMBL14590368 0.83 ATM (0.38) VNN1HSD11B1CHRM2CHRM4CHRM5
SCHEMBL19779512 0.83 ATM (0.38) VNN1HSD11B1CHRM2CHRM4CHRM5
SCHEMBL13207005 0.83 ATM (0.38) VNN1HSD11B1CHRM2CHRM4CHRM5
SCHEMBL24127285 0.78 VNN1 (0.38) VNN1HSD11B1CHRM2CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018122-A1 PYRIDAZINYL AMINO DERIVATIVES AS ALK5 INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2024-01-18 US disclosed
EP-3727364-A1 CARBAMATE AND UREA COMPOUNDS AS MULTIKINASE INHIBITORS Angex Pharmaceutical, Inc. (US) 2020-10-28 EP disclosed
EP-1719762-B1 NOVEL PYRIDINE DERIVATIVE AND PYRIMIDINE DERIVATIVE (1) EISAI R&D MAN CO LTD (JP) 2012-06-27 EP disclosed
US-7531532-B2 Hepatocyte growth factor receptor inhibitors; Antitumor agents, anticarcinogenic agents, angiogenesis inhibitors; pyrimidine derivatives like Pyrrolidine-1-carboxylic acid [6-(2-fluoro-4-{3-[2-(4-fluorophenyl)acetyl]thioureido}phenoxy)pyrimidin-4-yl]amide EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-05-12 US disclosed
US-20070270421-A1 Novel pyridine Derivative and Pyrimidine Derivative (1) EISAI R&D MANAGEMENT CO., LTD. (JP) 2007-11-22 US disclosed
EP-1719763-A1 NOVEL PYRIDINE DERIVATIVE AND PYRIMIDINE DERIVATIVE (2) Eisai Co., Ltd. (JP) 2006-11-08 EP disclosed
EP-1719762-A1 NOVEL PYRIDINE DERIVATIVE AND PYRIMIDINE DERIVATIVE (1) Eisai Co., Ltd. (JP) 2006-11-08 EP disclosed
US-20050277652-A1 Novel pyridine derivative and pyrimidine derivative EISAI CO., LTD. (JP) 2005-12-15 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 (3 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-20070270421-A1 Novel pyridine Derivative and Pyrimidine Derivative (1) HGF, MET, FLT1 VNN1 4394/4885HSD11B1 1002/4885CHRM2 1228/4885
US-20240018122-A1 PYRIDAZINYL AMINO DERIVATIVES AS ALK5 INHIBITORS ALK, TGFBR1, ACVR1 VNN1 4668/4885HSD11B1 2944/4885CHRM2 1260/4885
US-20050277652-A1 Novel pyridine derivative and pyrimidine derivative HGF, MET, HDGF VNN1 4402/4885HSD11B1 1148/4885CHRM2 1399/4885

“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.