SCHEMBL4489320

SCHEMBL4489320

CN(CCCOc1cc(F)c(-c2c(O)nc3ncnn3c2C2CCCCCC2)c(F)c1)C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 12/20 0.34
HTR2C P28335 4/20 0.34
SLC6A4 P31645 4/20 0.34
HTR2A P28223 1/20 0.34
TDP1 Q9NUW8 1/20 0.31
PDK2 Q15119 1/20 0.31
DDB1 Q16531 1/20 0.31
CRBN Q96SW2 1/20 0.31
GPR119 Q8TDV5 1/20 0.31

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
SCHEMBL4482775 0.92 HTR2C (0.34) PDE2AHTR2CSLC6A4HTR2A
SCHEMBL4493516 0.90 PDE2A (0.37) PDE2A
SCHEMBL4486630 0.81 PDE2A (0.37) PDE2A
SCHEMBL3223559 0.78 PDE2A (0.38) PDE2A
SCHEMBL4488290 0.77 PDE2A (0.35) PDE2A
SCHEMBL4494835 0.77 PDE2A (0.35) PDE2A
SCHEMBL4494001 0.77 PDE2A (0.35) PDE2A
SCHEMBL4501144 0.76 PDE2A (0.41) PDE2A
SCHEMBL4480515 0.75 PDE2A (0.39) PDE2A
SCHEMBL4486210 0.75 PDE2A (0.35) PDE2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7507739-B2 6-[(substituted)phenyl]triazolopyrimidines as anticancer agents WYETH (US) 2009-03-24 US disclosed
EP-1680425-B1 6- [(SUBSTITUTED)PHENYL] TRIAZOLOPYRIMIDINES AS ANTICANCER AGENTS WYETH CORP (US) 2007-01-10 EP disclosed
US-20050090508-A1 6-[(Substituted)phenyl]triazolopyrimidines as anticancer agents WYETH HOLDINGS CORPORATION (US) 2005-04-28 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-20050090508-A1 6-[(Substituted)phenyl]triazolopyrimidines as anticancer agents ABCC1, ABCB1, TUBB6 PDE2A 3428/4885HTR2C 4541/4885SLC6A4 875/4885

“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.