SCHEMBL683672

SCHEMBL683672

CC(C)C(c1ccccc1)c1cccc(F)c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.49
TDO2 P48775 1/20 0.49
MTOR P42345 1/20 0.43
AOC3 Q16853 1/20 0.42
SLC6A4 P31645 3/20 0.42
SLC6A2 P23975 2/20 0.41
HDAC4 P56524 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
CNR2 P34972 1/20 0.41
ACHE P22303 1/20 0.40
KDM4E B2RXH2 1/20 0.40
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
NFE2L2 Q16236 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
OPRL1 P41146 1/20 0.39

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
SCHEMBL10442326 0.94 AOC3 (0.46) IDO1TDO2MTORAOC3SLC6A4
Ammonia Solution, Strong SCHEMBL6001272 0.92 AOC3 (0.45) IDO1TDO2MTORAOC3SLC6A4
SCHEMBL21910184 0.90 AOC3 (0.41) IDO1TDO2AOC3HDAC4HDAC7
SCHEMBL23126382 0.86 IDO1 (0.47) IDO1TDO2OPRM1OPRD1OPRK1
SCHEMBL8330722 0.85 IDO1 (0.46) IDO1TDO2MTORAOC3SLC6A4
SCHEMBL23159277 0.83 IDO1 (0.41) IDO1TDO2MTORAOC3SLC6A4
SCHEMBL17069287 0.81 NPC1 (0.44) SLC6A4KDM4ENFE2L2
SCHEMBL17069292 0.81 NPC1 (0.44) SLC6A4KDM4ENFE2L2
SCHEMBL683626 0.81 NPC1 (0.44) SLC6A4KDM4ENFE2L2
SCHEMBL15586 0.80 TAAR1 (0.48) AOC3KDM4E

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 7 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-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-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN BRAINCELLS INC. (US) 2011-11-03 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-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG IDO1 1773/4885TDO2 3317/4885MTOR 529/4885
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN NGF, DCX, BDNF IDO1 1319/4885TDO2 4111/4885MTOR 1588/4885
US-10669272-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG IDO1 1773/4885TDO2 3317/4885MTOR 529/4885
US-10954238-B1 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG IDO1 1773/4885TDO2 3317/4885MTOR 529/4885

“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.