SCHEMBL18640943

SCHEMBL18640943

Oc1ncnc2c1ccn2C1CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIP4K2A P48426 1/20 0.43
ADORA2A P29274 4/20 0.39
MEN1 O00255 1/20 0.37
RIPK2 O43353 2/20 0.36
YTHDC1 Q96MU7 1/20 0.36
ACACB O00763 1/20 0.36
UBA6 A0AVT1 2/20 0.36
SRC P12931 3/20 0.35
ABL1 P00519 2/20 0.35
EGFR P00533 2/20 0.35
ABL2 P42684 2/20 0.35
ADK P55263 1/20 0.35
PI4KA P42356 3/20 0.34
PI4K2B Q8TCG2 3/20 0.34
PI4K2A Q9BTU6 3/20 0.34
PI4KB Q9UBF8 3/20 0.34
ADORA3 P0DMS8 2/20 0.34
ADORA1 P30542 2/20 0.34
ADORA2B P29275 1/20 0.34
PRMT5 O14744 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
SCHEMBL16967987 0.79 PIP4K2A (0.49) PIP4K2AADORA2AMEN1RIPK2YTHDC1
SCHEMBL15636715 0.76 PIP4K2A (0.45) PIP4K2AUBA6SRCABL1EGFR
SCHEMBL1442965 0.76 PIP4K2A (0.45) PIP4K2AUBA6SRCABL1EGFR
SCHEMBL24753099 0.73 PIP4K2A (0.44) PIP4K2AADORA2AMEN1ACACBSRC
SCHEMBL20674649 0.73 TOP2A (0.33) PIP4K2APRMT5WDR77
SCHEMBL1939828 0.73 PIP4K2A (0.44) PIP4K2AADORA2AMEN1ACACBSRC
SCHEMBL10242174 0.73 ADORA2A (0.56) ADORA2AMEN1SRCABL1EGFR
SCHEMBL1441891 0.73 PIP4K2A (0.42) PIP4K2AMEN1ACACBPRMT5WDR77
SCHEMBL17877686 0.72 PIP4K2A (0.44) PIP4K2AADORA2AACACBSRCABL1
SCHEMBL16254729 0.70 METTL3 (0.53) ADORA2AMEN1SRCABL1EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10435388-B2 Selective inhibitors of clinically important mutants of the EGFR tyrosine kinase CS PHARMATECH LIMITED (KY) 2019-10-08 US disclosed
US-20190023689-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE HIGH GREAT INVESTMENT LIMITED (HK) 2019-01-24 US disclosed
US-20180237441-A1 Chemical Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2018-08-23 US disclosed
EP-3350185-A1 1-PHENYLPYRROLIDIN-2-ONE DERIVATIVES AS PERK INHIBITORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2018-07-25 EP disclosed
WO-2017046737-A1 1-PHENYLPYRROLIDIN-2-ONE DERIVATIVES AS PERK INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-03-23 WO disclosed
WO-2017046737-A1 1-PHENYLPYRROLIDIN-2-ONE DERIVATIVES AS PERK INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-03-23 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 (3 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-10435388-B2 Selective inhibitors of clinically important mutants of the EGFR tyrosine kinase EGFR, ERBB3, ERBB2 PIP4K2A 676/4885ADORA2A 4789/4885MEN1 3422/4885
US-20180237441-A1 Chemical Compounds PSEN1, IRS1, CPT1A PIP4K2A 871/4885ADORA2A 3467/4885MEN1 1729/4885
US-20190023689-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE EGFR, ERBB3, ERBB2 PIP4K2A 676/4885ADORA2A 4789/4885MEN1 3422/4885

“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.