SCHEMBL22442572

SCHEMBL22442572

C=CC(=O)N1CCC[C@@H](Nc2nc(Nc3ccc(N4CCOCC4)cc3F)c3c(c2F)CNC3=O)C1

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.83
EGFR P00533 16/20 0.83

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
SCHEMBL21707226 1.00 BTK (0.83) BTKEGFR
SCHEMBL28536320 1.00 BTK (0.83) BTKEGFR
SCHEMBL29948723 1.00 BTK (0.83) BTKEGFR
SCHEMBL29948662 1.00 BTK (0.83) BTKEGFR
SCHEMBL21706936 0.91 BTK (1.00) BTKEGFR
SCHEMBL21707234 0.91 BTK (1.00) BTKEGFR
SCHEMBL21707075 0.89 BTK (1.00) BTKEGFR
SCHEMBL21707229 0.89 BTK (0.85) BTKEGFR
SCHEMBL21707237 0.88 BTK (1.00) BTKEGFR
SCHEMBL22222727 0.88 BTK (1.00) BTKEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116096369-A Polymorphs of bruton's tyrosine kinase inhibitor, and preparation method and application thereof 上海海雁医药科技有限公司 2023-05-09 CN disclosed
CN-116096369-A Polymorphs of bruton's tyrosine kinase inhibitor, and preparation method and application thereof 上海海雁医药科技有限公司 2023-05-09 CN disclosed
CN-112334469-B BTK inhibitor and pharmaceutically acceptable salt and polymorph thereof and application thereof 上海海雁医药科技有限公司 2022-10-04 CN disclosed
CN-112334469-B BTK inhibitor and pharmaceutically acceptable salt and polymorph thereof and application thereof 上海海雁医药科技有限公司 2022-10-04 CN disclosed
US-20210395247-A1 BTK INHIBITORS, PHARMACEUTICALLY ACCEPTABLE SALTS, POLYMORPHS AND APPLICATION THEREOF YANGTZE RIVER PHARMACEUTICAL GROUP CO., LTD. (CN) 2021-12-23 US disclosed
US-20210395247-A1 BTK INHIBITORS, PHARMACEUTICALLY ACCEPTABLE SALTS, POLYMORPHS AND APPLICATION THEREOF YANGTZE RIVER PHARMACEUTICAL GROUP CO., LTD. (CN) 2021-12-23 US disclosed
EP-3851438-A1 BTK INHIBITOR, PHARMACEUTICALLY ACCEPTABLE SALT, POLYMORPH AND APPLICATION THEREOF Shanghai Haiyan Pharmaceutical Technology Co., Ltd (CN) 2021-07-21 EP disclosed
CN-112334469-A BTK inhibitor and pharmaceutically acceptable salt and polymorph thereof and application thereof 上海海雁医药科技有限公司 2021-02-05 CN disclosed
CN-112334469-A BTK inhibitor and pharmaceutically acceptable salt and polymorph thereof and application thereof 上海海雁医药科技有限公司 2021-02-05 CN disclosed
WO-2020187267-A1 BTK INHIBITOR, PHARMACEUTICALLY ACCEPTABLE SALT, POLYMORPH AND APPLICATION THEREOF 上海海雁医药科技有限公司 2020-09-24 WO disclosed
WO-2020187267-A1 BTK INHIBITOR, PHARMACEUTICALLY ACCEPTABLE SALT, POLYMORPH AND APPLICATION THEREOF 上海海雁医药科技有限公司 2020-09-24 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 (1 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-20210395247-A1 BTK INHIBITORS, PHARMACEUTICALLY ACCEPTABLE SALTS, POLYMORPHS AND APPLICATION THEREOF BTK, SYK, LYN BTK 1/4885EGFR 407/4885

“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.