SCHEMBL19100673

SCHEMBL19100673

Clc1nccc(-c2n[nH]c3ccccc23)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 5/20 0.59
MAPK10 P53779 2/20 0.52
MAPK8 P45983 2/20 0.52
MAPK9 P45984 2/20 0.52
IDO1 P14902 3/20 0.50
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 2/20 0.50
GAA P10253 2/20 0.50
ALPL P05186 1/20 0.50
HPGD P15428 1/20 0.50
TTK P33981 1/20 0.50
ITK Q08881 3/20 0.45
FGFR1 P11362 1/20 0.45
FLT1 P17948 1/20 0.45
IRAK4 Q9NWZ3 1/20 0.43
FLT3 P36888 1/20 0.43
AURKA O14965 1/20 0.42
MAP2K4 P45985 1/20 0.41
PDPK1 O15530 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL2870463 0.81 LRRK2 (0.59) LRRK2MAPK10MAPK8MAPK9IDO1
SCHEMBL31084688 0.78 LRRK2 (0.55) LRRK2MAPK10MAPK8MAPK9IDO1
SCHEMBL5096658 0.78 LRRK2 (0.55) LRRK2MAPK10MAPK8MAPK9IDO1
SCHEMBL19100661 0.75 IDO1 (0.53) LRRK2MAPK10IDO1KDM4EALDH1A1
SCHEMBL1328336 0.75 LRRK2 (1.00) LRRK2MAPK10IDO1KDM4EALDH1A1
SCHEMBL30316298 0.75 LRRK2 (1.00) LRRK2MAPK10IDO1KDM4EALDH1A1
SCHEMBL20267512 0.74 LRRK2 (0.68) LRRK2MAPK10MAPK8MAPK9IDO1
SCHEMBL30116867 0.74 LRRK2 (0.68) LRRK2MAPK10MAPK8MAPK9IDO1
SCHEMBL19100191 0.74 ADORA2A (0.35) LRRK2MAPK10MAPK8MAPK9
SCHEMBL28467177 0.74 PIM1 (0.59) LRRK2MAPK10MAPK8MAPK9FLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3399968-B1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE CS PHARMATECH LTD (KY) 2021-10-20 EP disclosed
CN-109328059-B Selective inhibitors of clinically important mutants of EGFR tyrosine kinase CS制药技术有限公司 2021-08-17 CN disclosed
US-10435388-B2 Selective inhibitors of clinically important mutants of the EGFR tyrosine kinase CS PHARMATECH LIMITED (KY) 2019-10-08 US disclosed
CN-109328059-A Selective inhibitors of clinically important mutants of EGFR tyrosine kinase CS制药技术有限公司 2019-02-12 CN disclosed
US-20190023689-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE HIGH GREAT INVESTMENT LIMITED (HK) 2019-01-24 US disclosed
EP-3399968-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE CS Pharmatech Limited (KY) 2018-11-14 EP disclosed
WO-2017120429-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE CS Pharmasciences, Inc. (US) 2017-07-13 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 (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-10435388-B2 Selective inhibitors of clinically important mutants of the EGFR tyrosine kinase EGFR, ERBB3, ERBB2 LRRK2 422/4885MAPK10 66/4885MAPK8 463/4885
US-20190023689-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE EGFR, ERBB3, ERBB2 LRRK2 422/4885MAPK10 66/4885MAPK8 463/4885

“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.