SCHEMBL1265822

SCHEMBL1265822

COc1ccc(C(C)(C)C)cc1C(=O)Nc1ccc(C)c(Oc2ncccc2-c2ccncn2)c1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TEK Q02763 13/20 0.65
KDR P35968 12/20 0.65
YES1 P07947 1/20 0.45
GRM4 Q14833 1/20 0.44
AURKB Q96GD4 5/20 0.44
AURKA O14965 4/20 0.44
TPX2 Q9ULW0 4/20 0.44
LCK P06239 2/20 0.43
MAPK14 Q16539 2/20 0.43
ABL1 P00519 1/20 0.43
CSF1R P07333 1/20 0.43
KIT P10721 1/20 0.43
SRC P12931 1/20 0.43
BRAF P15056 1/20 0.43
KCNMA1 Q12791 1/20 0.43

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
SCHEMBL1265621 0.86 KDR (0.62) TEKKDRYES1AURKBAURKA
SCHEMBL1266232 0.84 TEK (0.87) TEKKDRYES1AURKBAURKA
SCHEMBL1264621 0.84 TEK (0.86) TEKKDRYES1LCKMAPK14
SCHEMBL2299669 0.83 TEK (0.73) TEKKDRYES1AURKBAURKA
SCHEMBL1264328 0.83 TEK (0.67) TEKKDRYES1AURKBAURKA
SCHEMBL1265479 0.82 TEK (0.86) TEKKDRYES1AURKBAURKA
SCHEMBL1264650 0.82 TEK (0.62) TEKKDRYES1GRM4AURKB
SCHEMBL1266384 0.80 TEK (0.60) TEKKDRYES1AURKBAURKA
SCHEMBL1265883 0.80 TEK (0.69) TEKKDRYES1AURKBAURKA
SCHEMBL5263118 0.80 TEK (0.61) TEKKDRYES1GRM4AURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8476434-B2 Protein kinase modulators and method of use AMGEN INC. (US) 2013-07-02 US claimed
US-20110201602-A1 PROTEIN KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2011-08-18 US claimed
EP-1751136-A2 NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER AMGEN INC. (US) 2007-02-14 EP claimed
US-20060009453-A1 Protein kinase modulators and method of use AMGEN INC. 2006-01-12 US claimed
WO-2005113494-A2 NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER AMGEN INC. (US) 2005-12-01 WO claimed
EP-1751136-B1 NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER AMGEN INC (US) 2014-07-02 EP disclosed
US-8476434-B2 Protein kinase modulators and method of use AMGEN INC. (US) 2013-07-02 US disclosed
US-8476434-B2 Protein kinase modulators and method of use AMGEN INC. (US) 2013-07-02 US disclosed
US-20110201602-A1 PROTEIN KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2011-08-18 US disclosed
US-20110201602-A1 PROTEIN KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2011-08-18 US disclosed
US-7880000-B2 N-(5-(1,1- dimethylethyl)-3- isoxazolyl)-4-methyl-3- ((3-(4-pyrimidinyl)-2- pyridinyl)amino)benzamide, used for treating breast cancer or rheumatoid arthritis AMGEN INC. (US) 2011-02-01 US disclosed
US-7880000-B2 N-(5-(1,1- dimethylethyl)-3- isoxazolyl)-4-methyl-3- ((3-(4-pyrimidinyl)-2- pyridinyl)amino)benzamide, used for treating breast cancer or rheumatoid arthritis AMGEN INC. (US) 2011-02-01 US disclosed
US-7880000-B2 N-(5-(1,1- dimethylethyl)-3- isoxazolyl)-4-methyl-3- ((3-(4-pyrimidinyl)-2- pyridinyl)amino)benzamide, used for treating breast cancer or rheumatoid arthritis AMGEN INC. (US) 2011-02-01 US disclosed
US-20060009453-A1 Protein kinase modulators and method of use AMGEN INC. 2006-01-12 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 (2 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-20060009453-A1 Protein kinase modulators and method of use PHKG1, PRKCH, BMP2K TEK 215/4885KDR 58/4885YES1 614/4885
US-20110201602-A1 PROTEIN KINASE MODULATORS AND METHOD OF USE GRK4, MAP4K5, GRK5 TEK 145/4885KDR 42/4885YES1 548/4885

“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.