SCHEMBL21831852

SCHEMBL21831852

C[C@@H]1CN[C@@H](C)CN1C(c1ccc(F)cc1)c1ccc(C#N)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DGKA P23743 4/20 0.46
DGKZ Q13574 4/20 0.46
SIGMAR1 Q99720 1/20 0.46
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
OPRD1 P41143 1/20 0.37
CYP19A1 P11511 3/20 0.37
HRH3 Q9Y5N1 1/20 0.36
SLC1A2 P43004 1/20 0.35
KCNH2 Q12809 1/20 0.35
EPHX2 P34913 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
SCHEMBL21831659 0.89 SIGMAR1 (0.54) DGKADGKZSIGMAR1OPRD1HRH3
SCHEMBL7427589 0.89 SIGMAR1 (0.54) DGKADGKZSIGMAR1OPRD1HRH3
SCHEMBL7427594 0.89 SIGMAR1 (0.54) DGKADGKZSIGMAR1OPRD1HRH3
SCHEMBL25328640 0.89 SIGMAR1 (0.54) DGKADGKZSIGMAR1OPRD1HRH3
SCHEMBL7430109 0.89 SIGMAR1 (0.54) DGKADGKZSIGMAR1OPRD1HRH3
SCHEMBL25327760 0.89 SIGMAR1 (0.54) DGKADGKZSIGMAR1OPRD1HRH3
SCHEMBL21831126 0.89 SIGMAR1 (0.54) DGKADGKZSIGMAR1OPRD1HRH3
Hydrochloric Acid SCHEMBL21831397 0.88 SIGMAR1 (0.53) DGKADGKZSIGMAR1OPRD1HRH3
SCHEMBL26944549 0.87 SIGMAR1 (0.40) DGKADGKZSIGMAR1KDM4ETP53
Hydrochloric Acid SCHEMBL26925943 0.86 SIGMAR1 (0.39) DGKADGKZSIGMAR1KDM4ETP53

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
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
EP-3814348-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS Bristol-Myers Squibb Company (US) 2021-05-05 EP 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 (5 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 DGKA 2/4885DGKZ 1/4885SIGMAR1 3220/4885
US-20200109140-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS DGKZ, DGKA, DGKG DGKA 2/4885DGKZ 1/4885SIGMAR1 3220/4885
US-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG DGKA 2/4885DGKZ 1/4885SIGMAR1 3220/4885
US-10669272-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG DGKA 2/4885DGKZ 1/4885SIGMAR1 3220/4885
US-10954238-B1 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG DGKA 2/4885DGKZ 1/4885SIGMAR1 3220/4885

“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.