SCHEMBL3055812

SCHEMBL3055812

CCOc1nc(N)c2c(n1)CCN(c1ccc(C(C)(C)C)cc1)C2=O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.47
PDGFRB P09619 2/20 0.36
KDR P35968 2/20 0.36
ADORA1 P30542 1/20 0.35
GRM5 P41594 3/20 0.34
F10 P00742 3/20 0.34
F2 P00734 1/20 0.34
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
PTGER4 P35408 1/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
RAB9A P51151 1/20 0.33
TYMS P04818 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 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
SCHEMBL3047616 0.88 DGAT1 (0.47) DGAT1PDGFRBKDRF10F2
SCHEMBL3040583 0.81 DGAT1 (0.48) DGAT1PDGFRBKDRF10F2
SCHEMBL3049488 0.80 F10 (0.48) DGAT1F10F2
SCHEMBL3043918 0.80 F10 (0.49) DGAT1F10F2
SCHEMBL3046119 0.79 DGAT1 (0.38) DGAT1F10F2
SCHEMBL3047238 0.79 F10 (0.48) DGAT1F10F2
SCHEMBL3054150 0.79 DGAT1 (0.40) DGAT1F10F2
SCHEMBL3047655 0.79 F10 (0.38) DGAT1F10F2
SCHEMBL3042805 0.78 DGAT1 (0.38) DGAT1F10F2
SCHEMBL3049225 0.78 DGAT1 (0.65) DGAT1PDGFRBKDR

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
WO-2010089686-A1 4-AMINO-7,8-DIHYDROPYRIDO[4,3-D]PYRIMIDIN-5(6H)-ONE DERIVATIVES PFIZER INC. (US) 2010-08-12 WO disclosed
US-20100197591-A1 4-AMINO-7,8-DIHYDROPYRIDO[4,3-d]PYRIMIDIN-5(6H)-ONE DERIVATIVES PFIZER INC 2010-08-05 US disclosed
US-20100197591-A1 4-AMINO-7,8-DIHYDROPYRIDO[4,3-d]PYRIMIDIN-5(6H)-ONE DERIVATIVES PFIZER INC 2010-08-05 US disclosed
US-20100197591-A1 4-AMINO-7,8-DIHYDROPYRIDO[4,3-d]PYRIMIDIN-5(6H)-ONE DERIVATIVES PFIZER INC 2010-08-05 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-20100197591-A1 4-AMINO-7,8-DIHYDROPYRIDO[4,3-d]PYRIMIDIN-5(6H)-ONE DERIVATIVES CDK7, DPYD, DHFR DGAT1 4223/4885PDGFRB 301/4885KDR 552/4885

“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.