SCHEMBL21910774

SCHEMBL21910774

C[C@H]1CN(C(c2ccc(F)cc2)c2ccc(F)cc2)[C@H](CO)CN1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 2/20 0.45
▸ HRH3 Q9Y5N1 1/20 0.38
▸ DPP8 Q6V1X1 1/20 0.35
▸ XIAP P98170 3/20 0.33
▸ BIRC2 Q13490 3/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ OPRD1 P41143 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ OPRL1 P41146 1/20 0.33
▸ ACHE P22303 1/20 0.32

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
SCHEMBL29922860 1.00 SIGMAR1 (0.45) SIGMAR1HRH3DPP8XIAPBIRC2
SCHEMBL21910451 1.00 SIGMAR1 (0.45) SIGMAR1HRH3DPP8XIAPBIRC2
Hydrochloric Acid SCHEMBL21831114 0.99 SIGMAR1 (0.44) SIGMAR1HRH3DPP8XIAPBIRC2
Hydrochloric Acid SCHEMBL21830987 0.99 SIGMAR1 (0.44) SIGMAR1HRH3DPP8XIAPBIRC2
SCHEMBL26925439 0.88 SIGMAR1 (0.46) SIGMAR1HRH3DPP8ACHE
SCHEMBL21910443 0.86 SIGMAR1 (0.45) SIGMAR1HRH3DPP8OPRM1OPRD1
Hydrochloric Acid SCHEMBL26925963 0.86 SIGMAR1 (0.45) SIGMAR1HRH3DPP8
SCHEMBL26944561 0.86 XIAP (0.41) XIAPBIRC2OPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL26925809 0.85 XIAP (0.41) XIAPBIRC2OPRM1OPRD1OPRK1
SCHEMBL21910362 0.84 SIGMAR1 (0.46) SIGMAR1HRH3XIAPBIRC2

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 3220/4885HRH3 741/4885DPP8 3019/4885
US-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG SIGMAR1 3220/4885HRH3 741/4885DPP8 3019/4885
US-10669272-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG SIGMAR1 3220/4885HRH3 741/4885DPP8 3019/4885
US-10954238-B1 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG SIGMAR1 3220/4885HRH3 741/4885DPP8 3019/4885

“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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