SCHEMBL23759756

SCHEMBL23759756

COc1cc(N2CCC(N3CCOCC3)CC2)c(-c2cnn(C)c2)cc1Nc1ncc(Br)c(Nc2ccc3nc(C4CC4)ccc3c2P(C)(C)=O)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.58
▸ BTK Q06187 2/20 0.55
▸ CHEK1 O14757 1/20 0.51
▸ AURKA O14965 1/20 0.51
▸ CCNT1 O60563 1/20 0.51
▸ JAK2 O60674 1/20 0.51
▸ RET P07949 1/20 0.51
▸ MET P08581 1/20 0.51
▸ ROS1 P08922 1/20 0.51
▸ PDGFRB P09619 1/20 0.51
▸ KIT P10721 1/20 0.51
▸ PIM1 P11309 1/20 0.51
▸ PDGFRA P16234 1/20 0.51
▸ FER P16591 1/20 0.51
▸ EPHA1 P21709 1/20 0.51
▸ MAPK3 P27361 1/20 0.51
▸ EPHB2 P29323 1/20 0.51
▸ AXL P30530 1/20 0.51
▸ MAPK8 P45983 1/20 0.51
▸ CDK9 P50750 1/20 0.51

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
SCHEMBL23759661 0.94 EGFR (0.63) EGFR
SCHEMBL23759767 0.93 EGFR (0.59) EGFR
SCHEMBL29857374 0.92 EGFR (0.55) EGFRBTK
SCHEMBL22951346 0.92 EGFR (0.55) EGFRBTK
SCHEMBL28535528 0.91 EGFR (0.61) EGFRBTK
SCHEMBL23759824 0.91 EGFR (0.59) EGFRBTK
SCHEMBL28836704 0.90 EGFR (0.50) EGFRBTK
SCHEMBL26427022 0.90 EGFR (0.50) EGFRBTKCHEK1AURKACCNT1
SCHEMBL22950964 0.89 EGFR (0.52) EGFRBTKCHEK1AURKACCNT1
SCHEMBL23759752 0.89 EGFR (0.52) EGFRBTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114885607-B Quinolinylphosphine oxide compounds, compositions and uses thereof 贝达药业股份有限公司 2024-05-14 — — CN claimed
CN-114885607-A Quinolylphosphine oxygen compounds, compositions and uses thereof 贝达药业股份有限公司 2022-08-09 — — CN claimed
CN-114885607-B Quinolinylphosphine oxide compounds, compositions and uses thereof 贝达药业股份有限公司 2024-05-14 — — CN disclosed
US-20230131025-A1 QUINOLYL PHOSPHINE OXIDE COMPOUND, AND COMPOSITION AND APPLICATION THEREOF BETTA PHARMACEUTICALS CO., LTD. (CN) 2023-04-27 — — US disclosed
US-20230131025-A1 QUINOLYL PHOSPHINE OXIDE COMPOUND, AND COMPOSITION AND APPLICATION THEREOF BETTA PHARMACEUTICALS CO., LTD. (CN) 2023-04-27 — — US disclosed
CN-114885607-A Quinolylphosphine oxygen compounds, compositions and uses thereof 贝达药业股份有限公司 2022-08-09 — — CN disclosed
WO-2021160087-A1 QUINOLYL PHOSPHINE OXIDE COMPOUND, AND COMPOSITION AND APPLICATION THEREOF 贝达药业股份有限公司 2021-08-19 — — 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-20230131025-A1 QUINOLYL PHOSPHINE OXIDE COMPOUND, AND COMPOSITION AND APPLICATION THEREOF EGFR, ABL1, ERBB2 EGFR 1/4885BTK 55/4885CHEK1 389/4885

“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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