SCHEMBL22048342

SCHEMBL22048342

CC(C)C(c1ccccc1)c1cccc(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.40
TDO2 P48775 2/20 0.40
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
GAA P10253 1/20 0.36
TAAR1 Q96RJ0 1/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
SLC6A3 Q01959 2/20 0.33
HRH1 P35367 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 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
SCHEMBL17069283 0.86 IDO1 (0.47) IDO1TDO2CES2CES1GAA
SCHEMBL17069280 0.86 IDO1 (0.47) IDO1TDO2CES2CES1GAA
SCHEMBL684363 0.86 IDO1 (0.47) IDO1TDO2CES2CES1GAA
SCHEMBL21910183 0.79 TAAR1 (0.36) IDO1TDO2TAAR1SLC6A2SLC6A4
SCHEMBL21910181 0.76 ALDH1A1 (0.39) IDO1TDO2GAASLC6A2SLC6A4
SCHEMBL23085221 0.74 CES2 (0.43) CES2CES1SLC6A2MEN1KMT2A
SCHEMBL23126407 0.73 FFAR1 (0.41) IDO1TDO2CES2CES1GAA
SCHEMBL420964 0.73 GABRA1 (0.48) CES2CES1SLC6A2MEN1KMT2A
SCHEMBL21831230 0.73 CES2 (0.47) IDO1TDO2CES2CES1GAA
SCHEMBL30910879 0.73 CES2 (0.47) IDO1TDO2CES2CES1GAA

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
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-10669272-B2 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2020-06-02 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-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG IDO1 1773/4885TDO2 3317/4885CES2 4302/4885
US-10669272-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG IDO1 1773/4885TDO2 3317/4885CES2 4302/4885

“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.