SCHEMBL22712703

SCHEMBL22712703

C=CC(=O)Nc1cc(Nc2nc(Br)cn(C)c2=O)ccc1C1CCCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 8/20 0.44
▸ SCN9A Q15858 1/20 0.42
▸ EGFR P00533 5/20 0.40
▸ ERBB2 P04626 1/20 0.40
▸ ERBB3 P21860 1/20 0.40
▸ ERBB4 Q15303 1/20 0.40
▸ FPR2 P25090 1/20 0.39
▸ F13A1 P00488 5/20 0.39
▸ TGM2 P21980 5/20 0.39
▸ TGM1 P22735 5/20 0.39
▸ TGM3 Q08188 1/20 0.39
▸ JAK3 P52333 1/20 0.37

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
SCHEMBL21275145 1.00 BTK (0.44) BTKSCN9AEGFRERBB2ERBB3
SCHEMBL21275146 0.91 SCN9A (0.42) BTKSCN9AFPR2JAK3
SCHEMBL22712689 0.91 SCN9A (0.42) BTKSCN9AFPR2JAK3
SCHEMBL21275233 0.90 BTK (0.42) BTKEGFRJAK3
SCHEMBL22712699 0.86 SCN9A (0.44) BTKSCN9AFPR2
SCHEMBL21275166 0.86 SCN9A (0.44) BTKSCN9AFPR2
SCHEMBL30385106 0.83 BTK (0.44) BTKEGFRERBB2ERBB3ERBB4
SCHEMBL21275177 0.82 OPRM1 (0.34) BTKSCN9AEGFRFPR2JAK3
SCHEMBL10256994 0.76 JAK1 (0.42) BTKEGFRFPR2JAK3
SCHEMBL1393372 0.74 NAMPT (0.51) BTKJAK3

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
US-12637467-B2 Inhibitor of BTK and mutants thereof NEWAVE PHARMACEUTICAL INC. (US) 2026-05-26 — — US disclosed
US-20250045728-A1 INHIBITORS OF BTK AND MUTANTS THEREOF NEWAVE PHARMACEUTICAL INC. 2025-02-06 — — US disclosed
US-12086788-B2 Substituted pyrazines as inhibitors of BTK, and mutants thereof NEWAVE PHARMACEUTICAL INC. (US) 2024-09-10 — — US disclosed
US-20230140433-A1 INHIBITORS OF BTK AND MUTANTS THEREOF NEWAVE PHARMACEUTICAL INC. 2023-05-04 — — US disclosed
US-20220363689-A1 INHIBITOR OF BTK AND MUTANTS THEREOF NEWAVE PHARMACEUTICAL INC. 2022-11-17 — — US disclosed
US-11501284-B2 Substituted pyrazines as inhibitors of BTK, and mutants thereof NEWAVE PHARMACEUTICAL INC. (US) 2022-11-15 — — US disclosed
US-20220135569-A1 INHIBITOR OF BTK AND MUTANTS THEREOF NEWAVE PHARMACEUTICAL INC. 2022-05-05 — — US disclosed
CN-113939292-A Inhibitors of BTK and mutants thereof 广州麓鹏制药有限公司 2022-01-14 — — CN disclosed
WO-2021066958-A1 INHIBITOR OF BTK AND MUTANTS THEREOF NEWAVE PHARMACEUTICAL INC. (US) 2021-04-08 — — WO disclosed
US-20200377478-A1 INHIBITORS OF BTK AND MUTANTS THEREOF NEWAVE PHARMACEUTICAL INC. 2020-12-03 — — US disclosed
CN-111741959-A Inhibitors of BTK and mutants thereof 新波制药有限公司 2020-10-02 — — CN 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 (8 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-11501284-B2 Substituted pyrazines as inhibitors of BTK, and mutants thereof BTK, SYK, LYN BTK 1/4885SCN9A 2896/4885EGFR 1870/4885
US-20220363689-A1 INHIBITOR OF BTK AND MUTANTS THEREOF BTK, SYK, LYN BTK 1/4885SCN9A 1678/4885EGFR 927/4885
US-20220135569-A1 INHIBITOR OF BTK AND MUTANTS THEREOF BTK, SYK, LYN BTK 1/4885SCN9A 1818/4885EGFR 970/4885
US-20250045728-A1 INHIBITORS OF BTK AND MUTANTS THEREOF BTK, SYK, LYN BTK 1/4885SCN9A 2195/4885EGFR 860/4885
US-20230140433-A1 INHIBITORS OF BTK AND MUTANTS THEREOF BTK, SYK, LYN BTK 1/4885SCN9A 2195/4885EGFR 860/4885
US-12637467-B2 Inhibitor of BTK and mutants thereof BTK, CNKSR1, SYK BTK 1/4885SCN9A 549/4885EGFR 905/4885
US-12086788-B2 Substituted pyrazines as inhibitors of BTK, and mutants thereof BTK, SYK, LYN BTK 1/4885SCN9A 2896/4885EGFR 1870/4885
US-20200377478-A1 INHIBITORS OF BTK AND MUTANTS THEREOF BTK, SYK, LYN BTK 1/4885SCN9A 2328/4885EGFR 881/4885

“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.

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