SCHEMBL20249290

SCHEMBL20249290

CC1(N)CCN(c2ccc(C(C)(C)C)nn2)CC1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 20/20 0.43
KCNH2 Q12809 2/20 0.36
MAPK3 P27361 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL20249318 0.83 PTPN11 (0.37) PTPN11MAPK3MAPK1
SCHEMBL20249370 0.82 SCD (0.36) PTPN11
SCHEMBL18290954 0.80 PTPN11 (0.45) PTPN11KCNH2MAPK3MAPK1
SCHEMBL18291284 0.80 PTPN11 (0.45) PTPN11KCNH2MAPK3MAPK1
SCHEMBL20038134 0.79 OGA (0.41) PTPN11KCNH2MAPK3MAPK1
SCHEMBL20249268 0.78 HRH4 (0.51)
SCHEMBL20249305 0.77 TRPV1 (0.39)
SCHEMBL20249130 0.77 ALDH1A1 (0.51)
SCHEMBL20249099 0.77 BPTF (0.57) MAPK1
SCHEMBL20249147 0.74 LMNA (0.40)

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 1 patent. 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

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 PTPN11 200/4885KCNH2 3160/4885MAPK3 213/4885

“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.