SCHEMBL21910684

SCHEMBL21910684

C[C@@H]1CN[C@@H](C)CN1C(/C(N)=N/O)c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 3/20 0.46
▸ DRD2 P14416 1/20 0.30
▸ DRD3 P35462 1/20 0.30
▸ SLC6A3 Q01959 1/20 0.30
▸ KCNH2 Q12809 1/20 0.30
▸ HRH3 Q9Y5N1 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
SCHEMBL25882920 0.81 SIGMAR1 (0.33) SIGMAR1DRD2DRD3SLC6A3KCNH2
SCHEMBL21911488 0.81 SIGMAR1 (0.48) SIGMAR1
SCHEMBL21910398 0.78 SIGMAR1 (0.48) SIGMAR1
SCHEMBL21831647 0.77 MAPK14 (0.35) KCNH2
SCHEMBL21831264 0.77 MAPK14 (0.35) KCNH2
SCHEMBL25327760 0.77 SIGMAR1 (0.54) SIGMAR1HRH3
SCHEMBL21831659 0.77 SIGMAR1 (0.54) SIGMAR1HRH3
SCHEMBL7427589 0.77 SIGMAR1 (0.54) SIGMAR1HRH3
SCHEMBL25328640 0.77 SIGMAR1 (0.54) SIGMAR1HRH3
SCHEMBL21831126 0.77 SIGMAR1 (0.54) SIGMAR1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-01 — — US disclosed
US-10954238-B1 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2021-03-23 — — US disclosed
US-10669272-B2 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2020-06-02 — — US disclosed
US-20200109140-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS SYNGENE INTERNATIONAL LIMITED (IN) 2020-04-09 — — 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 (4 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-20200109140-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS DGKZ, DGKA, DGKG SIGMAR1 3220/4885DRD2 1033/4885DRD3 871/4885
US-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG SIGMAR1 3220/4885DRD2 1033/4885DRD3 871/4885
US-10669272-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG SIGMAR1 3220/4885DRD2 1033/4885DRD3 871/4885
US-10954238-B1 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG SIGMAR1 3220/4885DRD2 1033/4885DRD3 871/4885

“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