SCHEMBL9923766

SCHEMBL9923766

C=CC(=O)Nc1cccc(Nc2nc(Cl)ncc2C)c1

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BTK Q06187 9/20 0.74
EGFR P00533 13/20 0.72
ITK Q08881 6/20 0.72

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
SCHEMBL9945478 0.88 BTK (0.67) BTKEGFR
SCHEMBL13165493 0.87 BTK (0.82) BTKEGFRITK
SCHEMBL15814594 0.86 EGFR (0.74) BTKEGFRITK
SCHEMBL9945480 0.86 BTK (0.69) BTKEGFRITK
SCHEMBL13165494 0.86 BTK (0.84) BTKEGFRITK
SCHEMBL264837 0.85 EGFR (0.54) BTKEGFRITK
SCHEMBL16370843 0.85 EGFR (0.73) BTKEGFRITK
SCHEMBL2352426 0.85 BTK (1.00) BTKEGFRITK
SCHEMBL2230183 0.85 BTK (1.00) BTKEGFRITK
SCHEMBL13606336 0.84 EGFR (1.00) BTKEGFRITK

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10004741-B2 Solid forms of an epidermal growth factor receptor kinase inhibitor CELGENE CAR LLC (BM) 2018-06-26 US disclosed
US-10005738-B2 Salts of an epidermal growth factor receptor kinase inhibitor CELGENE CAR LLC (BM) 2018-06-26 US disclosed
US-20180072687-A1 HETEROARYL COMPOUNDS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY 2018-03-15 US disclosed
US-9867824-B2 Heterocyclic compounds and uses thereof CELGENE CAR LLC (BM) 2018-01-16 US disclosed
US-9868723-B2 Mutant-selective EGFR inhibitors and uses thereof CELGENE CAR LLC (BM) 2018-01-16 US disclosed
US-20170281623-A1 SOLID FORMS OF AN EPIDERMAL GROWTH FACTOR RECEPTOR KINASE INHIBITOR BRISTOL-MYERS SQUIBB COMPANY 2017-10-05 US disclosed
US-9765038-B2 Heteroaryl compounds and uses thereof CELGENE CAR LLC (BM) 2017-09-19 US disclosed
US-20170217904-A1 SALTS OF AN EPIDERMAL GROWTH FACTOR RECEPTOR KINASE INHIBITOR BRISTOL-MYERS SQUIBB COMPANY 2017-08-03 US disclosed
US-20170112833-A1 Tyrosine Kinase Inhibitor And Uses Thereof Xuanzhu Pharma Co., Ltd. (CN) 2017-04-27 US disclosed
US-20170027937-A1 Heterocyclic Compounds and Uses Thereof BRISTOL-MYERS SQUIBB COMPANY 2017-02-02 US disclosed
US-9108927-B2 Salts of an epidermal growth factor receptor kinase inhibitor CELGENE AVILOMICS RESEARCH, INC. (US) 2015-08-18 US disclosed
US-9056839-B2 Solid forms of an epidermal growth factor receptor kinase inhibitor CELGENE AVILOMICS RESEARCH, INC. (US) 2015-06-16 US disclosed
US-8975249-B2 Heterocyclic compounds and uses thereof CELGENE AVILOMICS RESEARCH, INC. (US) 2015-03-10 US disclosed
US-20150025055-A1 MUTANT-SELECTIVE EGFR INHIBITORS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY 2015-01-22 US disclosed
US-8796255-B2 Mutant-selective EGFR inhibitors and uses thereof Celgene Avilomics Research, Inc (US) 2014-08-05 US disclosed
US-20130267530-A1 SOLID FORMS OF AN EPIDERMAL GROWTH FACTOR RECEPTOR KINASE INHIBITOR BRISTOL-MYERS SQUIBB COMPANY 2013-10-10 US disclosed
US-20130267531-A1 SALTS OF AN EPIDERMAL GROWTH FACTOR RECEPTOR KINASE INHIBITOR CELGENE AVILOMICS RESEARCH, INC. (US) 2013-10-10 US disclosed
US-20120157426-A1 MUTANT-SELECTIVE EGFR INHIBITORS AND USES THEREOF AVILA THERAPEUTICS, INC. (US) 2012-06-21 US disclosed
US-20120149722-A1 HETEROARYL COMPOUNDS AND USES THEREOF AVILA THERAPEUTICS, INC. (US) 2012-06-14 US disclosed
US-20120149687-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF AVILA THERAPEUTICS, INC. (US) 2012-06-14 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 (13 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-20170217904-A1 SALTS OF AN EPIDERMAL GROWTH FACTOR RECEPTOR KINASE INHIBITOR EGFR, ERBB2, ERBB4 BTK 129/4885EGFR 1/4885ITK 288/4885
US-20180072687-A1 HETEROARYL COMPOUNDS AND USES THEREOF ABCG2, CYP3A43, CYP3A5 BTK 594/4885EGFR 1981/4885ITK 2697/4885
US-20170112833-A1 Tyrosine Kinase Inhibitor And Uses Thereof EGFR, ERBB2, ABL1 BTK 25/4885EGFR 1/4885ITK 84/4885
US-20170027937-A1 Heterocyclic Compounds and Uses Thereof ABCG2, CYP3A5, CYP3A43 BTK 988/4885EGFR 2849/4885ITK 2206/4885
US-10005738-B2 Salts of an epidermal growth factor receptor kinase inhibitor EGFR, ERBB2, ERBB4 BTK 129/4885EGFR 1/4885ITK 288/4885
US-20120149687-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF ABCG2, CYP3A5, CYP3A43 BTK 988/4885EGFR 2849/4885ITK 2206/4885
US-20150025055-A1 MUTANT-SELECTIVE EGFR INHIBITORS AND USES THEREOF EGFR, ERBB3, ERBB2 BTK 46/4885EGFR 1/4885ITK 662/4885
US-20170281623-A1 SOLID FORMS OF AN EPIDERMAL GROWTH FACTOR RECEPTOR KINASE INHIBITOR EGFR, ERBB2, ERBB3 BTK 154/4885EGFR 1/4885ITK 171/4885
US-20120149722-A1 HETEROARYL COMPOUNDS AND USES THEREOF ABCG2, CYP3A43, CYP3A5 BTK 594/4885EGFR 1981/4885ITK 2697/4885
US-20130267531-A1 SALTS OF AN EPIDERMAL GROWTH FACTOR RECEPTOR KINASE INHIBITOR EGFR, ERBB2, ERBB4 BTK 129/4885EGFR 1/4885ITK 288/4885
US-20130267530-A1 SOLID FORMS OF AN EPIDERMAL GROWTH FACTOR RECEPTOR KINASE INHIBITOR EGFR, ERBB2, ERBB3 BTK 124/4885EGFR 1/4885ITK 174/4885
US-10004741-B2 Solid forms of an epidermal growth factor receptor kinase inhibitor EGFR, ERBB2, ERBB3 BTK 154/4885EGFR 1/4885ITK 171/4885
US-20120157426-A1 MUTANT-SELECTIVE EGFR INHIBITORS AND USES THEREOF EGFR, ERBB3, ERBB2 BTK 46/4885EGFR 1/4885ITK 662/4885

“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.