SCHEMBL23809054

SCHEMBL23809054

CC(C)c1cn(CC(=O)N(C)C)c2ccc(-c3ncccn3)cc12

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 20/20 0.43
▸ GRIN1 Q05586 1/20 0.41

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
SCHEMBL23809510 0.85 GRIN2B (0.39) GRIN2BGRIN1
SCHEMBL26581651 0.85 GRIN2B (0.53) GRIN2B
SCHEMBL20604981 0.84 GRIN2B (0.44) GRIN2B
SCHEMBL23809057 0.83 MCL1 (0.44) GRIN2BGRIN1
SCHEMBL23809241 0.78 MCL1 (0.46) GRIN2BGRIN1
SCHEMBL23809421 0.76 DYRK1A (0.40) —
SCHEMBL23799893 0.75 GRIN2B (0.51) GRIN2BGRIN1
SCHEMBL23809334 0.74 KDR (0.37) —
SCHEMBL23809246 0.74 MEN1 (0.43) —
SCHEMBL23809336 0.73 ICMT (0.38) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210283138-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2021-09-16 — — 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 (1 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-20210283138-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 GRIN2B 3904/4885GRIN1 2916/4885

“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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