SCHEMBL16336629

SCHEMBL16336629

NC(=O)c1c(-c2ccc(Oc3ccccc3)cc2)nn(C2CCCN(C(=O)O)C2)c1N

nearest known ligand 0.82

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.82
EGFR P00533 7/20 0.82
SRC P12931 2/20 0.75

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
SCHEMBL18600659 1.00 BTK (0.82) BTKEGFRSRC
SCHEMBL19997537 0.93 BTK (0.79) BTKEGFRSRC
SCHEMBL15472582 0.90 BTK (1.00) BTKEGFRSRC
SCHEMBL15763030 0.90 BTK (0.75) BTKEGFRSRC
SCHEMBL15763031 0.90 BTK (0.75) BTKEGFRSRC
SCHEMBL15756482 0.90 BTK (1.00) BTKEGFRSRC
SCHEMBL15669774 0.90 BTK (1.00) BTKEGFRSRC
SCHEMBL16338332 0.89 BTK (0.67) BTKEGFRSRC
SCHEMBL18472776 0.89 BTK (0.85) BTKEGFRSRC
SCHEMBL18853844 0.89 BTK (0.85) BTKEGFRSRC

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-20200069796-A1 Therapeutic Combinations of a BTK Inhibitor, a PI3K Inhibitor, a JAK-2 Inhibitor, a PD-1 Inhibitor, and/or a PD-L1 Inhibitor ACERTA PHARMA BV (NL) 2020-03-05 US disclosed
EP-3402503-A1 THERAPEUTIC COMBINATIONS OF AN ANTIFOLATE AND A BTK INHIBITOR Acerta Pharma B.V. (NL) 2018-11-21 EP disclosed
US-10112922-B2 Inhibitor of bruton's tyrosine kinase CENTAURUS BIOPHARMA CO., LTD. (CN) 2018-10-30 US disclosed
WO-2017122175-A1 THERAPEUTIC COMBINATIONS OF AN ANTIFOLATE AND A BTK INHIBITOR ACERTA PHARMA B.V. (NL) 2017-07-20 WO disclosed
US-20170144986-A1 INHIBITOR OF BRUTON'S TYROSINE KINASE CENTAURUS BIOPHARMA CO., LTD. (CN) 2017-05-25 US disclosed
EP-3141546-A1 INHIBITOR OF BRUTON'S TYROSINE KINASE Centaurus Biopharma Co., Ltd. (CN) 2017-03-15 EP disclosed
WO-2017033113-A1 THERAPEUTIC COMBINATIONS OF A MEK INHIBITOR AND A BTK INHIBITOR ACERTA PHARMA B.V. (NL) 2017-03-02 WO disclosed
WO-2017025814-A1 METHODS OF TREATING CANCERS, IMMUNE AND AUTOIMMUNE DISEASES, AND INFLAMMATORY DISEASES BASED ON BTK OCCUPANCY AND BTK RESYNTHESIS RATE ACERTA PHARMA B.V. (NL) 2017-02-16 WO disclosed
WO-2016128912-A1 THERAPEUTIC COMBINATIONS OF A BTK INHIBITOR, A PI3K INHIBITOR, A JAK-2 INHIBITOR, A PD-1 INHIBITOR, AND/OR A PD-L1 INHIBITOR ACERTA PHARMA B.V. (NL) 2016-08-18 WO disclosed
WO-2016087994-A1 BTK INHIBITORS TO TREAT SOLID TUMORS THROUGH MODULATION OF THE TUMOR MICROENVIRONMENT ACERTA PHARMA B.V. (NL) 2016-06-09 WO disclosed
WO-2016024231-A1 THERAPEUTIC COMBINATIONS OF A BTK INHIBITOR, A PI3K INHIBITOR, A JAK-2 INHIBITOR, A PD-1 INHIBITOR AND/OR A PD-L1 INHIBITOR ACERTA PHARMA B.V. (NL) 2016-02-18 WO disclosed
WO-2016020901-A1 METHODS OF TREATING CANCERS, IMMUNE AND AUTOIMMUNE DISEASES, AND INFLAMMATORY DISEASES BASED ON BTK OCCUPANCY AND BTK RESYNTHESIS RATE ACERTA PHARMA B.V. (NL) 2016-02-11 WO disclosed
US-20150005277-A1 Protein Kinase Inhibitors and Uses Thereof BEIGENE, LTD. (KY) 2015-01-01 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 (4 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-20170144986-A1 INHIBITOR OF BRUTON'S TYROSINE KINASE BTK, SYK, LYN BTK 1/4885EGFR 618/4885SRC 6/4885
US-20150005277-A1 Protein Kinase Inhibitors and Uses Thereof BTK, ABL1, PRKACA BTK 1/4885EGFR 560/4885SRC 11/4885
US-20200069796-A1 Therapeutic Combinations of a BTK Inhibitor, a PI3K Inhibitor, a JAK-2 Inhibitor, a PD-1 Inhibitor, and/or a PD-L1 Inhibitor BTK, JAK1, PDCD1 BTK 1/4885EGFR 336/4885SRC 47/4885
US-10112922-B2 Inhibitor of bruton's tyrosine kinase BTK, SYK, LYN BTK 1/4885EGFR 618/4885SRC 6/4885

“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.