SCHEMBL4522230

SCHEMBL4522230

CC(C)(C)OC(=O)N1CCN(c2ncc3ncccc3n2)CC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.57
MAPT P10636 1/20 0.56
PTPN11 Q06124 1/20 0.55
ACHE P22303 2/20 0.54
POLB P06746 1/20 0.52
GBA1 P04062 1/20 0.52
CKS1B P61024 2/20 0.51
SKP1 P63208 2/20 0.51
SKP2 Q13309 2/20 0.51
SMO Q99835 1/20 0.47

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
SCHEMBL12964579 0.81 GPR119 (0.77) GPR119MAPTACHEPOLBCKS1B
SCHEMBL24970948 0.79 POLB (0.55) GPR119ACHEPOLBGBA1CKS1B
SCHEMBL30903372 0.79 POLB (0.55) GPR119ACHEPOLBGBA1CKS1B
SCHEMBL5369080 0.79 POLB (0.54) GPR119ACHEPOLBGBA1CKS1B
SCHEMBL16249699 0.78 PTPN11 (0.52) GPR119MAPTPTPN11ACHECKS1B
SCHEMBL4063357 0.77 CKS1B (0.69) GPR119MAPTPTPN11ACHEGBA1
SCHEMBL6786128 0.77 GPR119 (0.60) GPR119MAPTPTPN11ACHEPOLB
SCHEMBL2420167 0.77 POLB (0.52) GPR119MAPTACHEPOLBGBA1
SCHEMBL2419663 0.77 POLB (0.52) GPR119MAPTACHEPOLBGBA1
SCHEMBL6645424 0.77 GPR119 (0.57) GPR119MAPTPTPN11ACHEPOLB

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-20090264415-A2 PYRIDO(3,2-D)PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR MEDICAL TREATMENT 4 AZA IP NV (BE) 2009-10-22 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-20090264415-A2 PYRIDO(3,2-D)PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR MEDICAL TREATMENT PNPO, TYMP, PNP GPR119 1724/4885MAPT 1541/4885PTPN11 1566/4885

“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.