SCHEMBL1264376

SCHEMBL1264376

COc1ccc(C2CCCCC2)cc1NC(=O)c1ccc(C)c(Oc2ncccc2-c2ccnc(NCCCN3CCOCC3)c2)c1

nearest known ligand 0.74

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TEK Q02763 10/20 0.74
KDR P35968 8/20 0.60
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
MAPK14 Q16539 4/20 0.41
ABL1 P00519 2/20 0.41
BCR P11274 2/20 0.41
TYK2 P29597 1/20 0.40
JAK3 P52333 2/20 0.40
LCK P06239 1/20 0.40
EGFR P00533 1/20 0.39
ERBB2 P04626 1/20 0.39
TEC P42680 1/20 0.39
TXK P42681 1/20 0.39
BLK P51451 1/20 0.39
BMX P51813 1/20 0.39
BTK Q06187 1/20 0.39
ITK Q08881 1/20 0.39
ERBB4 Q15303 1/20 0.39

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
SCHEMBL1265596 0.89 TEK (0.73) TEKKDRCYP2D6CYP2C9MAPK14
SCHEMBL1265264 0.85 TEK (1.00) TEKKDR
SCHEMBL1264315 0.85 TEK (0.74) TEKKDRMAPK14JAK3LCK
SCHEMBL1265241 0.80 TEK (0.78) TEKKDRMAPK14ABL1BCR
SCHEMBL1265089 0.79 KDR (0.70) TEKKDRMAPK14LCK
SCHEMBL2296918 0.79 TEK (0.67) TEKKDRMAPK14JAK3LCK
SCHEMBL11896925 0.78 TEK (0.75) TEKKDR
SCHEMBL1264720 0.77 TEK (0.81) TEKKDRMAPK14LCKEGFR
SCHEMBL1264175 0.77 TEK (0.62) TEKKDRMAPK14ABL1BCR
SCHEMBL1266252 0.76 TEK (0.74) TEKKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
US-20110201602-A1 PROTEIN KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2011-08-18 US claimed
US-20060009453-A1 Protein kinase modulators and method of use AMGEN INC. 2006-01-12 US 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 58/4885CYP2D6 3644/4885
US-20110201602-A1 PROTEIN KINASE MODULATORS AND METHOD OF USE GRK4, MAP4K5, GRK5 TEK 145/4885KDR 42/4885CYP2D6 2996/4885

“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.