SCHEMBL23039979

SCHEMBL23039979

O=Cc1ccc(O[C@@H]2C[C@H]2C(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ KMT2A Q03164 2/20 0.41
▸ CYP2A6 P11509 1/20 0.40
▸ PARP10 Q53GL7 1/20 0.40
▸ PARP3 Q9Y6F1 1/20 0.40
▸ ALDH1A3 P47895 1/20 0.37
▸ FFAR4 Q5NUL3 1/20 0.36
▸ STS P08842 1/20 0.36

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
SCHEMBL28750680 1.00 ALDH1A1 (0.47) ALDH1A1KDM4EKMT2ACYP2A6PARP10
SCHEMBL27878721 0.80 FFAR4 (0.44) KMT2AFFAR4
SCHEMBL24658820 0.79 RXRA (0.39) ALDH1A1FFAR4
SCHEMBL23182928 0.79 ALDH1A1 (0.44) ALDH1A1KMT2AFFAR4
SCHEMBL23055169 0.79 ALDH1A1 (0.41) ALDH1A1KDM4EKMT2ACYP2A6
SCHEMBL29130069 0.75 ALDH1A1 (0.53) ALDH1A1KDM4EKMT2ACYP2A6PARP10
SCHEMBL29270941 0.74 FFAR4 (0.39) ALDH1A1KMT2AFFAR4
SCHEMBL23040148 0.74 FFAR4 (0.39) ALDH1A1KMT2AFFAR4
SCHEMBL29270939 0.74 FFAR4 (0.39) ALDH1A1KMT2AFFAR4
SCHEMBL23039953 0.73 FFAR4 (0.38) ALDH1A1KMT2AFFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230151007-A1 SUBSTITUTED PYRIDOPYRIMIDINONYL COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2023-05-18 — — US disclosed
US-11584747-B2 Substituted pyridopyrimidinonyl compounds useful as T cell activators SYNGENE INTERNATIONAL LIMITED (IN) 2023-02-21 — — US disclosed
EP-4021901-A1 SUBSTITUTED PYRIDOPYRIMIDINONYL COMPOUNDS USEFUL AS T CELL ACTIVATORS Bristol-Myers Squibb Company (US) 2022-07-06 — — EP disclosed
CN-114302884-A Substituted pyridopyrimidinone based compounds useful as T cell activators 百时美施贵宝公司 2022-04-08 — — CN disclosed
WO-2021041588-A1 SUBSTITUTED PYRIDOPYRIMIDINONYL COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2021-03-04 — — WO disclosed
US-20210061802-A1 SUBSTITUTED PYRIDOPYRIMIDINONYL COMPOUNDS USEFUL AS T CELL ACTIVATORS SYNGENE INTERNATIONAL LIMITED (IN) 2021-03-04 — — 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 (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-11584747-B2 Substituted pyridopyrimidinonyl compounds useful as T cell activators DGKZ, DGKA, DGKG ALDH1A1 4233/4885KDM4E 1828/4885KMT2A 2162/4885
US-20210061802-A1 SUBSTITUTED PYRIDOPYRIMIDINONYL COMPOUNDS USEFUL AS T CELL ACTIVATORS DGKZ, DGKA, DGKG ALDH1A1 4233/4885KDM4E 1828/4885KMT2A 2162/4885
US-20230151007-A1 SUBSTITUTED PYRIDOPYRIMIDINONYL COMPOUNDS USEFUL AS T CELL ACTIVATORS DGKZ, DGKA, DGKG ALDH1A1 4022/4885KDM4E 1866/4885KMT2A 1907/4885

“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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