SCHEMBL23367234

SCHEMBL23367234

CCCC[C@](C)(CO)Nc1nc(Cl)nc2cc(Br)cnc12

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 9/20 0.64
▸ TLR7 Q9NYK1 3/20 0.50
▸ CYP1A2 P05177 1/20 0.30

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
SCHEMBL21612967 1.00 TLR8 (0.64) TLR8TLR7CYP1A2
SCHEMBL29758962 1.00 TLR8 (0.64) TLR8TLR7CYP1A2
SCHEMBL18109531 0.89 TLR8 (0.80) TLR8TLR7CYP1A2
SCHEMBL18109530 0.89 TLR8 (0.80) TLR8TLR7CYP1A2
SCHEMBL19432226 0.88 TLR8 (0.77) TLR8TLR7CYP1A2
SCHEMBL20991219 0.88 TLR8 (0.77) TLR8TLR7CYP1A2
SCHEMBL18109305 0.87 TLR8 (0.77) TLR8TLR7CYP1A2
SCHEMBL18109303 0.87 TLR8 (0.77) TLR8TLR7CYP1A2
SCHEMBL21611722 0.87 TLR8 (0.78) TLR8TLR7
SCHEMBL20991215 0.80 TLR8 (0.76) TLR8TLR7CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12269823-B2 Crystal form of pyridopyrimidine derivative and preparation method thereof JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2025-04-08 — — US disclosed
EP-4484426-A1 PYRIMIDO AROMATIC RING COMPOUND AND USE THEREOF IN DRUG Sunshine Lake Pharma Co., Ltd. (CN) 2025-01-01 — — EP disclosed
US-12162879-B2 Pyridopyrimidine derivative, preparation method therefor and medical use thereof JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2024-12-10 — — US disclosed
CN-116693527-A Pyrimido aromatic ring compounds and application thereof in medicines 广东东阳光药业股份有限公司 2023-09-05 — — CN disclosed
WO-2023160527-A1 PYRIMIDO AROMATIC RING COMPOUND AND USE THEREOF IN DRUG 广东东阳光药业股份有限公司 2023-08-31 — — WO disclosed
CN-114929232-B Crystal form of pyridopyrimidine derivative and preparation method thereof 江苏恒瑞医药股份有限公司 2023-06-16 — — CN disclosed
CN-115710266-A Pyridopyrimidine derivative, preparation method thereof and application thereof in medicines 江苏恒瑞医药股份有限公司 2023-02-24 — — CN disclosed
US-20230058425-A1 CRYSTAL FORM OF PYRIDOPYRIMIDINE DERIVATIVE AND PREPARATION METHOD THEREOF JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2023-02-23 — — US disclosed
CN-111094289-B Pyridopyrimidine derivative, preparation method thereof and application thereof in medicine 江苏恒瑞医药股份有限公司 2022-11-22 — — CN disclosed
EP-4085914-A1 CRYSTAL FORM OF PYRIDOPYRIMIDINE DERIVATIVE AND PREPARATION METHOD THEREOF Jiangsu Hengrui Medicine Co., Ltd. (CN) 2022-11-09 — — EP disclosed
CN-114929232-A Crystal form of pyridopyrimidine derivative and preparation method thereof 江苏恒瑞医药股份有限公司 2022-08-19 — — CN disclosed
CN-113082224-A Pyridopyrimidine derivative conjugate, preparation method thereof and application thereof in medicines 江苏恒瑞医药股份有限公司 2021-07-09 — — CN disclosed
EP-3822271-A1 PYRIDOPYRIMIDINE DERIVATIVE, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF Jiangsu Hengrui Medicine Co., Ltd. (CN) 2021-05-19 — — EP disclosed
CN-111094289-A Pyridopyrimidine derivative, preparation method thereof and application thereof in medicine 江苏恒瑞医药股份有限公司 2020-05-01 — — 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 (3 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-12269823-B2 Crystal form of pyridopyrimidine derivative and preparation method thereof DPYD, PNPO, PDXK TLR8 4239/4885TLR7 3122/4885CYP1A2 57/4885
US-12162879-B2 Pyridopyrimidine derivative, preparation method therefor and medical use thereof TLR8, TLR7, TLR1 TLR8 1/4885TLR7 2/4885CYP1A2 1002/4885
US-20230058425-A1 CRYSTAL FORM OF PYRIDOPYRIMIDINE DERIVATIVE AND PREPARATION METHOD THEREOF DPYD, PNPO, PDXK TLR8 4239/4885TLR7 3122/4885CYP1A2 57/4885

“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.

Send feedback