SCHEMBL16371058

SCHEMBL16371058

COc1cc(N2CCC(N(C)C)CC2)ccc1Nc1ncc(Cl)c(Nc2ccccc2C(=O)C(=O)N2CCOCC2)n1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 13/20 0.79
▸ EGFR P00533 6/20 0.79
▸ MAPK8 P45983 2/20 0.70
▸ MAPK9 P45984 2/20 0.70
▸ MAPK10 P53779 2/20 0.70
▸ INSR P06213 7/20 0.70
▸ IGF1R P08069 6/20 0.70
▸ AURKA O14965 2/20 0.70
▸ ROS1 P08922 2/20 0.70
▸ PLK1 P53350 2/20 0.70
▸ LRRK2 Q5S007 2/20 0.70
▸ CDC7 O00311 1/20 0.70
▸ PLK4 O00444 1/20 0.70
▸ CHEK1 O14757 1/20 0.70
▸ DCLK1 O15075 1/20 0.70
▸ PDPK1 O15530 1/20 0.70
▸ DAPK3 O43293 1/20 0.70
▸ DYRK3 O43781 1/20 0.70
▸ JAK2 O60674 1/20 0.70
▸ PRKD3 O94806 1/20 0.70

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
SCHEMBL16372264 0.91 PTK2 (0.72) ALKEGFRMAPK8MAPK9MAPK10
SCHEMBL16371449 0.90 MAPK8 (0.74) ALKEGFRMAPK8MAPK9MAPK10
SCHEMBL16371689 0.89 ALK (0.74) ALKEGFRMAPK8MAPK9MAPK10
SCHEMBL16371266 0.89 ALK (0.87) ALKEGFRMAPK8MAPK9MAPK10
SCHEMBL16371316 0.89 ALK (0.87) ALKEGFRMAPK8MAPK9MAPK10
SCHEMBL16371604 0.89 ALK (0.86) ALKEGFRMAPK8MAPK9MAPK10
SCHEMBL16371803 0.89 ALK (1.00) ALKEGFRMAPK8MAPK9MAPK10
SCHEMBL16371168 0.88 ALK (0.85) ALKEGFRMAPK8MAPK9MAPK10
SCHEMBL16372087 0.88 ALK (0.85) ALKEGFRMAPK8MAPK9MAPK10
SCHEMBL16370907 0.87 ALK (0.84) ALKEGFRMAPK8MAPK9MAPK10

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-20160145237-A1 PROTEIN TYROSINE KINASE MODULATORS AND METHODS OF USE BETTA PHARMACEUTICALS CO., LTD (CN) 2016-05-26 — — US claimed
EP-3019489-A1 PROTEIN TYROSINE KINASE MODULATORS AND METHODS OF USE Betta Pharmaceuticals Co., Ltd. (CN) 2016-05-18 — — EP claimed
WO-2015003658-A1 PROTEIN TYROSINE KINASE MODULATORS AND METHODS OF USE BETTA PHARMACEUTICALS CO., LTD (CN) 2015-01-15 — — WO claimed
US-10059688-B2 Protein tyrosine kinase modulators and methods of use BETTA PHARMACEUTICALS CO., LTD. (CN) 2018-08-28 — — US disclosed
US-20180009782-A1 PROTEIN TYROSINE KINASE MODULATORS AND METHODS OF USE BETTA PHARMACEUTICALS CO., LTD. (CN) 2018-01-11 — — US disclosed
US-20180009782-A1 PROTEIN TYROSINE KINASE MODULATORS AND METHODS OF USE BETTA PHARMACEUTICALS CO., LTD. (CN) 2018-01-11 — — US disclosed
US-9783524-B2 Protein tyrosine kinase modulators and methods of use BETTA PHARMACEUTICALS CO., LTD. (CN) 2017-10-10 — — US disclosed
US-9783524-B2 Protein tyrosine kinase modulators and methods of use BETTA PHARMACEUTICALS CO., LTD. (CN) 2017-10-10 — — US disclosed
US-9783524-B2 Protein tyrosine kinase modulators and methods of use BETTA PHARMACEUTICALS CO., LTD. (CN) 2017-10-10 — — US disclosed
US-20160145237-A1 PROTEIN TYROSINE KINASE MODULATORS AND METHODS OF USE BETTA PHARMACEUTICALS CO., LTD (CN) 2016-05-26 — — US disclosed
US-20160145237-A1 PROTEIN TYROSINE KINASE MODULATORS AND METHODS OF USE BETTA PHARMACEUTICALS CO., LTD (CN) 2016-05-26 — — US disclosed
US-20160145237-A1 PROTEIN TYROSINE KINASE MODULATORS AND METHODS OF USE BETTA PHARMACEUTICALS CO., LTD (CN) 2016-05-26 — — US disclosed
WO-2015003658-A1 PROTEIN TYROSINE KINASE MODULATORS AND METHODS OF USE BETTA PHARMACEUTICALS CO., LTD (CN) 2015-01-15 — — WO 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-20160145237-A1 PROTEIN TYROSINE KINASE MODULATORS AND METHODS OF USE ALK, EGFR, ERBB2 ALK 1/4885EGFR 2/4885MAPK8 307/4885
US-10059688-B2 Protein tyrosine kinase modulators and methods of use ALK, EGFR, ERBB2 ALK 1/4885EGFR 2/4885MAPK8 307/4885
US-20180009782-A1 PROTEIN TYROSINE KINASE MODULATORS AND METHODS OF USE ALK, EGFR, ERBB2 ALK 1/4885EGFR 2/4885MAPK8 307/4885

“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.

Send feedback