SCHEMBL6318975

SCHEMBL6318975

Nc1nc(Nc2cccc(OC(F)(F)F)c2)ncc1-c1cnc2ccccc2c1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 3/20 0.62
SYK P43405 2/20 0.53
CTSC P53634 3/20 0.53
EGFR P00533 4/20 0.44
ITK Q08881 3/20 0.44
ALPL P05186 2/20 0.43
BRAF P15056 1/20 0.42
BTK Q06187 1/20 0.41
CDK2 P24941 1/20 0.41
GSK3B P49841 1/20 0.41
MAP4K1 Q92918 1/20 0.40
ABL1 P00519 1/20 0.40
BCR P11274 1/20 0.40
PRKCA P17252 1/20 0.40

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
SCHEMBL6311735 0.91 CTSC (0.50) IGF1RSYKCTSCALPLGSK3B
SCHEMBL6314422 0.87 IGF1R (0.60) IGF1RSYKEGFRALPLCDK2
SCHEMBL6312806 0.83 IGF1R (0.47) IGF1REGFRCDK2
SCHEMBL6312636 0.81 CDK5 (0.47) IGF1RSYKABL1
SCHEMBL6312590 0.80 IGF1R (0.58) IGF1REGFRALPLCDK2GSK3B
SCHEMBL6318900 0.79 IGF1R (0.58) IGF1RSYKEGFR
SCHEMBL6312020 0.79 SYK (0.47) IGF1RSYKEGFR
SCHEMBL6642105 0.77 DHFR (0.56) IGF1REGFRCDK2
SCHEMBL6312056 0.77 IGF1R (0.60) IGF1REGFRCDK2
SCHEMBL6312155 0.77 RAB9A (0.46) IGF1R

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
US-6939874-B2 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. (US) 2005-09-06 US disclosed
EP-1427421-A1 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS Amgen Inc. (US) 2004-06-16 EP disclosed
US-20040063705-A1 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. 2004-04-01 US disclosed
WO-2003018021-A1 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS AMGEN INC. (US) 2003-03-06 WO 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-20040063705-A1 Substituted pyrimidinyl derivatives and methods of use DPYD, TYMP, TPMT IGF1R 4054/4885SYK 928/4885CTSC 721/4885

“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.