SCHEMBL22394455

SCHEMBL22394455

C=CC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1OC(CC)C1COCCN1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.66
▸ ERBB3 P21860 4/20 0.65
▸ DUS2 Q9NX74 1/20 0.65
▸ ERBB2 P04626 6/20 0.60
▸ SRC P12931 3/20 0.60
▸ ERBB4 Q15303 3/20 0.60
▸ KIT P10721 2/20 0.60
▸ KDR P35968 2/20 0.60
▸ CIT O14578 2/20 0.60
▸ GAK O14976 2/20 0.60
▸ EPHB6 O15197 2/20 0.60
▸ RIPK2 O43353 2/20 0.60
▸ STK10 O94804 2/20 0.60
▸ ABL1 P00519 2/20 0.60
▸ LCK P06239 2/20 0.60
▸ LYN P07948 2/20 0.60
▸ RET P07949 2/20 0.60
▸ MET P08581 2/20 0.60
▸ HCK P08631 2/20 0.60
▸ AXL P30530 2/20 0.60

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
SCHEMBL27580641 0.86 EGFR (0.65) EGFRERBB3DUS2ERBB2SRC
SCHEMBL22394465 0.85 EGFR (0.61) EGFRERBB3ERBB2SRCERBB4
Hydrochloric Acid SCHEMBL28384466 0.84 EGFR (0.60) EGFRERBB3ERBB2SRCERBB4
SCHEMBL4787463 0.83 EGFR (0.70) EGFRERBB3DUS2ERBB2SRC
SCHEMBL2266659 0.80 EGFR (1.00) EGFRERBB3ERBB2SRCERBB4
SCHEMBL21801932 0.80 EGFR (1.00) EGFRERBB3DUS2ERBB2SRC
SCHEMBL29478966 0.80 EGFR (1.00) EGFRERBB3DUS2ERBB2SRC
SCHEMBL29617536 0.80 EGFR (1.00) EGFRERBB3DUS2ERBB2SRC
SCHEMBL28428839 0.79 KDR (0.52) EGFRERBB3ERBB2SRCERBB4
SCHEMBL19634180 0.77 EGFR (0.73) EGFRERBB3DUS2ERBB2SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112955137-A Combination therapy 米拉蒂治疗股份有限公司 2021-06-11 — — CN claimed
CN-117327059-A Compounds that inhibit and induce protein degradation 北京泰德制药股份有限公司 2024-01-02 — — CN disclosed
CN-117222435-A HER 2-targeted Fc antigen binding fragment-drug conjugates 默克专利有限公司 2023-12-12 — — CN disclosed
CN-113912589-B Compounds that inhibit and induce protein degradation 北京泰德制药股份有限公司 2023-10-20 — — CN disclosed
WO-2023198180-A1 EGFR DEGRADATION AGENT 北京泰德制药股份有限公司 2023-10-19 — — WO disclosed
EP-3705478-B1 TRIAZINE COMPOUND AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF SHENZHEN FORWARD PHARMACEUTICALS CO LTD (CN) 2023-10-04 — — EP disclosed
CN-114829364-B Compounds that inhibit and induce degradation of EGFR kinase 北京泰德制药股份有限公司 2023-08-22 — — CN disclosed
CN-116507337-A ATR inhibitors and uses thereof 上海德琪医药科技有限公司 2023-07-28 — — CN disclosed
CN-116462685-A Heterocyclic compound, pharmaceutical composition containing same and antitumor application of heterocyclic compound 和径医药科技(上海)有限公司 2023-07-21 — — CN disclosed
CN-109843858-B Certain chemical entities, compositions and methods 润新生物公司 2023-05-05 — — CN disclosed
CN-114340622-A Asparagine Endopeptidase (AEP) inhibitors, compositions and uses related thereto 埃莫里大学 2022-04-12 — — CN disclosed
WO-2021121261-A1 COMPOUND FOR INHIBITING AND INDUCING DEGRADATION OF EGFR KINASE 北京泰德制药股份有限公司 2021-06-24 — — WO disclosed
WO-2021036922-A1 COMPOUND INHIBITING AND INDUCING DEGRADATION OF EGFR AND ALK 北京泰德制药股份有限公司 2021-03-04 — — WO disclosed
WO-2020200158-A1 N-HETEROAROMATIC AMIDE DERIVATIVES FOR TREATMENT OF CANCER 深圳福沃药业有限公司 2020-10-08 — — WO disclosed
EP-3705478-A1 TRIAZINE COMPOUND AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Shenzhen Forward Pharmaceuticals Co., Ltd. (CN) 2020-09-09 — — EP disclosed
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