SCHEMBL23780910

SCHEMBL23780910

O=c1[nH]c2ccc(Br)nc2c(CCl)c1[N+](=O)[O-]

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 17/20 0.36
GRIN3B O60391 17/20 0.36
GRIN1 Q05586 17/20 0.36
GRIN2A Q12879 17/20 0.36
GRIN2B Q13224 17/20 0.36
GRIN2C Q14957 17/20 0.36
GRIN3A Q8TCU5 17/20 0.36
HCRTR1 O43613 1/20 0.36
PKM P14618 1/20 0.36
GRIA1 P42261 1/20 0.34
GRIA2 P42262 1/20 0.34
GRIA3 P42263 1/20 0.34
GRIA4 P48058 1/20 0.34
TYMS P04818 1/20 0.33

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
SCHEMBL23726042 0.71
SCHEMBL23725416 0.69 ADRB2 (0.31)
SCHEMBL23725883 0.64 HTR6 (0.43)
SCHEMBL28193414 0.63 SMN1; SMN2 (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30166996 0.62 PDE10A (0.37)
SCHEMBL23612096 0.62 PDE10A (0.37)
SCHEMBL28193883 0.62 GAA (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL28193301 0.61 GAA (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5259002 0.61 GRIN2D (0.60) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31179419 0.61 PKM (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11866430-B2 Naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2024-01-09 US disclosed
US-20210277004-A1 NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2021-09-09 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 (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-11866430-B2 Naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG GRIN2D 3402/4885GRIN3B 3049/4885GRIN1 1650/4885
US-20210277004-A1 NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS DGKZ, DGKA, DGKG GRIN2D 3402/4885GRIN3B 3049/4885GRIN1 1650/4885

“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.