SCHEMBL1265150

SCHEMBL1265150

CNc1nccc(-c2cccnc2Oc2cccc(C(=O)Nc3cc(C(F)(F)F)ccc3N3CCCCC3)c2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TEK Q02763 16/20 1.00
KDR P35968 12/20 0.81
AURKA O14965 2/20 0.58
AURKB Q96GD4 2/20 0.58
TPX2 Q9ULW0 2/20 0.58
LCK P06239 2/20 0.58
MAPK14 Q16539 2/20 0.58
ABL1 P00519 1/20 0.58
CSF1R P07333 1/20 0.58
KIT P10721 1/20 0.58
SRC P12931 1/20 0.58
YES1 P07947 1/20 0.56
SRPK2 P78362 1/20 0.53
SRPK1 Q96SB4 1/20 0.53
SRPK3 Q9UPE1 1/20 0.53
JAK3 P52333 1/20 0.52
LMNA P02545 1/20 0.49
MAPT P10636 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
SCHEMBL1266590 0.90 TEK (1.00) TEKKDRAURKAAURKBTPX2
SCHEMBL1264167 0.90 TEK (1.00) TEKKDRAURKAAURKBTPX2
SCHEMBL2298956 0.89 TEK (1.00) TEKKDRAURKAAURKBTPX2
SCHEMBL1265942 0.89 TEK (1.00) TEKKDRAURKAAURKBTPX2
SCHEMBL1264957 0.88 TEK (0.99) TEKKDRAURKAAURKBTPX2
SCHEMBL2296568 0.87 TEK (0.85) TEKKDRAURKAAURKBTPX2
SCHEMBL2294951 0.87 TEK (0.79) TEKKDRAURKAAURKBTPX2
SCHEMBL1266514 0.84 TEK (0.73) TEKKDRAURKAAURKBTPX2
SCHEMBL1264439 0.83 TEK (0.88) TEKKDRAURKAAURKBTPX2
SCHEMBL1265206 0.83 TEK (0.89) TEKKDRAURKAAURKBTPX2

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 13 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

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 58/4885AURKA 516/4885
US-20110201602-A1 PROTEIN KINASE MODULATORS AND METHOD OF USE GRK4, MAP4K5, GRK5 TEK 145/4885KDR 42/4885AURKA 402/4885

“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.