SCHEMBL20927131

SCHEMBL20927131

C=CC(O)Nc1cccc(Nc2nc(Nc3ccc(OCC(O)CO)c(F)c3)ncc2F)c1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 17/20 0.63
▸ ITK Q08881 9/20 0.63
▸ SYK P43405 2/20 0.49
▸ BTK Q06187 1/20 0.49

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
SCHEMBL20927092 0.90 EGFR (0.59) EGFRITKSYKBTK
SCHEMBL12519793 0.86 EGFR (0.83) EGFRITK
SCHEMBL12519661 0.77 EGFR (1.00) EGFRITKBTK
SCHEMBL24486525 0.77 EGFR (0.73) EGFRITKSYKBTK
SCHEMBL13166579 0.77 EGFR (0.75) EGFRITKSYKBTK
SCHEMBL13165908 0.77 EGFR (0.79) EGFRITKBTK
SCHEMBL656179 0.76 SYK (0.69) EGFRITKSYKBTK
SCHEMBL29722547 0.75 EGFR (0.78) EGFRITKBTK
SCHEMBL12519437 0.75 EGFR (0.78) EGFRITKBTK
SCHEMBL13498252 0.74 EGFR (0.70) EGFRITKSYKBTK

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-10828300-B2 Substituted 2,4-diaminopyrimidines as kinase inhibitors CELGENE CAR LLC (BM) 2020-11-10 — — US disclosed
US-20190117650-A1 HETEROARYL COMPOUNDS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY 2019-04-25 — — US disclosed
US-20160130295-A1 MODULAR RADIOCHEMISTRY SYNTHESIS SYSTEM THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-05-12 — — 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 (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-20160130295-A1 MODULAR RADIOCHEMISTRY SYNTHESIS SYSTEM RAD18, MVD, USP18 EGFR 1683/4885ITK 2398/4885SYK 801/4885
US-10828300-B2 Substituted 2,4-diaminopyrimidines as kinase inhibitors ABL1, DCK, ERBB2 EGFR 176/4885ITK 352/4885SYK 494/4885
US-20190117650-A1 HETEROARYL COMPOUNDS AND USES THEREOF ABCG2, CYP3A43, CYP3A5 EGFR 1981/4885ITK 2697/4885SYK 2370/4885

“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.

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