SCHEMBL29545307

SCHEMBL29545307

COc1ncc(-c2ccc3c(c2)c(C(C)=O)cn3CC(=O)OC(C)(C)C)cn1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.39
▸ CFD P00746 5/20 0.38
▸ SERPINE1 P05121 1/20 0.37
▸ GPR119 Q8TDV5 1/20 0.37
▸ PLA2G4A P47712 1/20 0.36
▸ P2RX3 P56373 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ DYRK1B Q9Y463 1/20 0.36
▸ FTO Q9C0B1 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ PIK3CA P42336 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ SYK P43405 1/20 0.35

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
SCHEMBL17024802 1.00 PKM (0.39) PKMCFDSERPINE1GPR119PLA2G4A
SCHEMBL25282966 0.90 CFD (0.44) PKMCFDSERPINE1PLA2G4AKMT2A
SCHEMBL17037519 0.87 CFD (0.41) PKMCFDPLA2G4AP2RX3KMT2A
SCHEMBL17024799 0.86 CFD (0.41) PKMCFDSERPINE1PLA2G4AP2RX3
SCHEMBL29545109 0.86 CFD (0.41) PKMCFDSERPINE1PLA2G4AP2RX3
SCHEMBL18578623 0.84 CFD (0.42) CFDSERPINE1PLA2G4ASMN1; SMN2
SCHEMBL29841251 0.84 CFD (0.42) CFDSERPINE1PLA2G4ASMN1; SMN2
SCHEMBL21547488 0.84 GRIN2B (0.37) GPR119P2RX3DYRK1BFTOPIK3CA
SCHEMBL20330241 0.83 PKM (0.33) PKMCFDPIK3CAKDM4EALDH1A1
SCHEMBL20329727 0.83 CFD (0.37) CFD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4129407-B1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS INC (US) 2024-12-25 — — EP disclosed
US-12139497-B2 Aryl, heteroaryl, and heterocyclic compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2024-11-12 — — US disclosed
US-12065459-B2 Aryl, heteroaryl, and heterocyclic compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2024-08-20 — — US disclosed
US-20230287005-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2023-09-14 — — US disclosed
EP-4129407-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS Achillion Pharmaceuticals, Inc. (US) 2023-02-08 — — EP disclosed
EP-3340981-B1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS INC (US) 2022-10-12 — — EP disclosed
EP-3623367-B1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS INC (US) 2022-09-28 — — EP disclosed
EP-4053117-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS Achillion Pharmaceuticals, Inc. (US) 2022-09-07 — — EP disclosed
CN-114044800-A Aryl, heteroaryl and heterocyclic compounds for the treatment of medical disorders 艾其林医药公司 2022-02-15 — — 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-20230287005-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, F12, F3 PKM 3878/4885CFD 1/4885SERPINE1 39/4885
US-12065459-B2 Aryl, heteroaryl, and heterocyclic compounds for treatment of complement mediated disorders TFPI, CFD, F3 PKM 4613/4885CFD 2/4885SERPINE1 29/4885
US-12139497-B2 Aryl, heteroaryl, and heterocyclic compounds for treatment of medical disorders CFD, F12, F3 PKM 3975/4885CFD 1/4885SERPINE1 40/4885

“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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