SCHEMBL29922426

SCHEMBL29922426

C[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H](C)CN1C(c1ccc(F)cc1)C(F)(F)CO

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TACR1 P25103 6/20 0.42
▸ GPR119 Q8TDV5 1/20 0.36
▸ RORC P51449 2/20 0.34
▸ KCNH2 Q12809 2/20 0.33
▸ PDK1 Q15118 1/20 0.33
▸ PDK2 Q15119 1/20 0.33
▸ PDK3 Q15120 1/20 0.33
▸ PDK4 Q16654 1/20 0.33
▸ MAPK14 Q16539 1/20 0.33
▸ KDM4D Q6B0I6 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33

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
SCHEMBL29922641 0.90 TACR1 (0.40) TACR1GPR119RORCKCNH2MAPK14
SCHEMBL29922598 0.87 TACR1 (0.39) TACR1GPR119RORCMAPK14KDM4D
SCHEMBL21831657 0.86 DPP8 (0.36) KCNH2PDK1PDK2PDK3PDK4
SCHEMBL29922523 0.84 TACR1 (0.39) TACR1GPR119RORC
SCHEMBL29922699 0.84 TACR1 (0.42) TACR1GPR119KCNH2MAPK14HDAC1
SCHEMBL29922480 0.83 MAPK14 (0.44) TACR1GPR119MAPK14KDM4DHDAC1
SCHEMBL29922490 0.83 MAPK14 (0.44) TACR1GPR119MAPK14KDM4DHDAC1
SCHEMBL29922715 0.83 MAPK14 (0.44) TACR1GPR119MAPK14KDM4DHDAC1
SCHEMBL30554491 0.83 MAPK14 (0.44) TACR1GPR119MAPK14KDM4DHDAC1
SCHEMBL26944415 0.83 MAPK14 (0.44) TACR1GPR119MAPK14KDM4DHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112654621-B Substituted naphthyridinone compounds useful as T cell activators 百时美施贵宝公司 2024-05-14 — — CN disclosed
EP-3814348-B9 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2023-11-01 — — EP disclosed
EP-3814348-B1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2023-08-02 — — EP disclosed
US-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-01 — — US disclosed
US-20220324859-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2022-10-13 — — US 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 (2 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-20220324859-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS DGKZ, DGKA, DGKG TACR1 2439/4885GPR119 1749/4885RORC 301/4885
US-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG TACR1 2439/4885GPR119 1749/4885RORC 301/4885

“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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