SCHEMBL19699862

SCHEMBL19699862

CN(C)CCN(C)C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRNB2 P17787 1/20 0.39
CHRM3 P20309 1/20 0.39
CHRNA4 P43681 1/20 0.39
GBA1 P04062 1/20 0.37
HDAC6 Q9UBN7 2/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
CA14 Q9ULX7 3/20 0.37
PDK2 Q15119 1/20 0.36
CA12 O43570 2/20 0.33
CA7 P43166 2/20 0.33
CA1 P00915 1/20 0.33
FPR3 P25089 1/20 0.33
FPR2 P25090 1/20 0.33
CACNA1G O43497 1/20 0.33
CACNA1B Q00975 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
SCHEMBL18257000 0.94 CA14 (0.42) CHRM2CHRM4CHRM5CHRM1CHRNB2
SCHEMBL25479216 0.94 CA14 (0.42) CHRM2CHRM4CHRM5CHRM1CHRNB2
SCHEMBL10260946 0.93 HDAC6 (0.40) CHRM2CHRM4CHRM5CHRM1CHRNB2
SCHEMBL7244461 0.88 HDAC6 (0.39) CHRM2CHRM4CHRM5CHRM1CHRNB2
SCHEMBL25720861 0.86 ALDH1A1 (0.42) CHRM2CHRM4CHRM5CHRM1CHRNB2
SCHEMBL3293559 0.85 HDAC6 (0.40) CHRM1GBA1HDAC6HDAC1HDAC2
SCHEMBL19607386 0.85 CA14 (0.39) GBA1HDAC6HDAC1HDAC2CA14
SCHEMBL20762898 0.85 GBA1 (0.39) GBA1HDAC6HDAC1HDAC2CA14
SCHEMBL25795585 0.85 HDAC6 (0.36) CHRM2CHRM4CHRM5CHRM1CHRNB2
SCHEMBL22651094 0.84 PDK2 (0.36) CHRM2CHRM4CHRM5CHRM1CHRNB2

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-20240208967-A1 Pyrimidine or Pyridine Compounds, Preparation Method Therefor and Pharmaceutical Uses Thereof INVENTISBIO CO LTD (CN) 2024-06-27 US disclosed
US-20230293535-A1 ERBB/BTK INHIBITORS DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2023-09-21 US disclosed
EP-4186900-A1 CODRUG THAT DISINTEGRATES IN INTESTINE, PREPARATION THEREFOR, AND USE THEREOF Ennovabio (Zhejiang) Pharmaceuticals Co., Ltd. (CN) 2023-05-31 EP disclosed
US-20170355696-A1 PYRIMIDINE OR PYRIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF InventisBio Co., Ltd. (CN) 2017-12-14 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-20240208967-A1 Pyrimidine or Pyridine Compounds, Preparation Method Therefor and Pharmaceutical Uses Thereof EGFR, WEE1, DPYD CHRM2 4790/4885CHRM4 4751/4885CHRM5 4822/4885
US-20170355696-A1 PYRIMIDINE OR PYRIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF EGFR, WEE1, DPYD CHRM2 4791/4885CHRM4 4713/4885CHRM5 4831/4885
US-20230293535-A1 ERBB/BTK INHIBITORS ERBB2, BTK, ERBB3 CHRM2 4464/4885CHRM4 4365/4885CHRM5 4737/4885

“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.