SCHEMBL20249509

SCHEMBL20249509

CN(C)[C@H]1CCN(C(=O)c2ccc(C(C)(C)C)nc2)C1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
VNN1 O95497 18/20 0.57
L3MBTL3 Q96JM7 1/20 0.55
HRH3 Q9Y5N1 1/20 0.49

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
SCHEMBL20249516 1.00 VNN1 (0.57) VNN1L3MBTL3HRH3
SCHEMBL20249503 0.93 L3MBTL3 (0.65) VNN1L3MBTL3
SCHEMBL5909079 0.90 L3MBTL3 (0.55) VNN1L3MBTL3HRH3
SCHEMBL5909268 0.84 L3MBTL3 (0.58) VNN1L3MBTL3HRH3
SCHEMBL5908969 0.84 L3MBTL3 (0.58) VNN1L3MBTL3HRH3
SCHEMBL12776429 0.84 VNN1 (0.47) VNN1L3MBTL3
SCHEMBL24185771 0.82 L3MBTL3 (0.57) VNN1L3MBTL3HRH3
SCHEMBL20037662 0.82 L3MBTL3 (0.57) VNN1L3MBTL3HRH3
SCHEMBL22164612 0.82 L3MBTL3 (0.57) VNN1L3MBTL3HRH3
SCHEMBL20037660 0.82 L3MBTL3 (0.57) VNN1L3MBTL3HRH3

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-20180161329-A1 PYRIDO[3,4-D]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF TEIJIN PHARMA LIMITED (JP) 2018-06-14 US disclosed
US-20180161329-A1 PYRIDO[3,4-D]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF TEIJIN PHARMA LIMITED (JP) 2018-06-14 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 (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-20180161329-A1 PYRIDO[3,4-D]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF CDK4, CDK6, CDK16 VNN1 3630/4885L3MBTL3 4221/4885HRH3 2304/4885

“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.