SCHEMBL10108217

SCHEMBL10108217

CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(C)c3)c2cc1NC(=O)/C=C/CN(C)C

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.85
ERBB2 P04626 16/20 0.85
STK25 O00506 1/20 0.85
CIT O14578 1/20 0.85
CHEK1 O14757 1/20 0.85
GAK O14976 1/20 0.85
DAPK3 O43293 1/20 0.85
JAK2 O60674 1/20 0.85
STK17B O94768 1/20 0.85
STK10 O94804 1/20 0.85
MAP4K4 O95819 1/20 0.85
ABL1 P00519 1/20 0.85
LCK P06239 1/20 0.85
FYN P06241 1/20 0.85
FES P07332 1/20 0.85
CSF1R P07333 1/20 0.85
YES1 P07947 1/20 0.85
LYN P07948 1/20 0.85
MET P08581 1/20 0.85
HCK P08631 1/20 0.85

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
SCHEMBL14944414 0.93 EGFR (0.85) EGFRERBB2STK25CITCHEK1
Pelitinib SCHEMBL29349785 0.92 EGFR (1.00) EGFRERBB2STK25CITCHEK1
Pelitinib SCHEMBL93757 0.92 EGFR (1.00) EGFRERBB2STK25CITCHEK1
Pelitinib SCHEMBL93756 0.92 EGFR (1.00) EGFRERBB2STK25CITCHEK1
Pelitinib SCHEMBL29352012 0.92 EGFR (1.00) EGFRERBB2STK25CITCHEK1
Pelitinib SCHEMBL29385637 0.92 EGFR (1.00) EGFRERBB2STK25CITCHEK1
Pelitinib SCHEMBL29623744 0.92 EGFR (1.00) EGFRERBB2STK25CITCHEK1
SCHEMBL20251032 0.90 EGFR (0.85) EGFRERBB2STK25CITCHEK1
SCHEMBL12641774 0.89 EGFR (0.72) EGFRERBB2STK25CITCHEK1
SCHEMBL22431978 0.88 EGFR (0.80) EGFRERBB2STK25CITCHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE49851-E1 Pyridinylaminopyrimidine derivatives, preparation process and use thereof SHANGHAI ALLIST PHARMACEUTICALS CO., LTD. (CN) 2024-02-27 US disclosed
US-20160354375-A1 CASEIN KINASE 1delta (CK 1delta) INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES SUCH AS TAUOPATHIES ELECTROPHORETICS LIMITED (GB) 2016-12-08 US disclosed
US-8216571-B2 Fully human anti-VEGF antibodies and methods of using SCHERING CORPORATION (US) 2012-07-10 US disclosed
US-20120077811-A1 PRODRUG FORMS OF KINASE INHIBITORS AND THEIR USE IN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2012-03-29 US disclosed
US-8017735-B2 Comprising one or more binding compositions comprising a member selected from a light chain amino acid sequence which comprises CDR-L1 and a heavy chain amino acid sequence which comprises CDR-H1 in association with one or more chemotherapeutic agents; cancer therapy SCHERING CORPORATION (US) 2011-09-13 US disclosed
US-20110130706-A1 SEQUENTIAL BODY SURFACE TREATMENT FOLLICA, INC. (US) 2011-06-02 US disclosed
US-20110097340-A1 FULLY HUMAN ANTI-VEGF ANTIBODIES AND METHODS OF USING XOMA TECHNOLOGY LTD. 2011-04-28 US disclosed
US-20110009387-A1 HISTONE H2AX (HH2AX) BIOMARKER FOR FTI SENSITIVITY SCHERING CORPORATION 2011-01-13 US disclosed
US-20100092490-A1 METHOD FOR ASSAY ON THE EFFECT OF VASCULARIZATION INHIBITOR EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-04-15 US disclosed
US-20080090242-A1 PANEL OF BIOMARKERS FOR PREDICTION OF FTI EFFICACY SCHERING CORPORATION 2008-04-17 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 (5 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-20110097340-A1 FULLY HUMAN ANTI-VEGF ANTIBODIES AND METHODS OF USING VEGFA, KDR, FLT4 EGFR 104/4885ERBB2 173/4885STK25 2238/4885
US-20120077811-A1 PRODRUG FORMS OF KINASE INHIBITORS AND THEIR USE IN THERAPY NTRK3, TK1, TNNI3K EGFR 48/4885ERBB2 7/4885STK25 124/4885
US-20160354375-A1 CASEIN KINASE 1delta (CK 1delta) INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES SUCH AS TAUOPATHIES CSNK1G1, CSNK1A1, CSNK1D EGFR 1834/4885ERBB2 734/4885STK25 289/4885
US-20100092490-A1 METHOD FOR ASSAY ON THE EFFECT OF VASCULARIZATION INHIBITOR VEGFA, FLT4, MKI67 EGFR 8/4885ERBB2 34/4885STK25 1106/4885
US-20110009387-A1 HISTONE H2AX (HH2AX) BIOMARKER FOR FTI SENSITIVITY TERF2IP, TERF2, DOT1L EGFR 4244/4885ERBB2 3959/4885STK25 539/4885

“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.