SCHEMBL23809214

SCHEMBL23809214

CC(C)c1cn(CC(=O)N2CCCC2)c2ccc(-c3ncn(C)n3)cc12

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.41
▸ GRIN2B Q13224 11/20 0.41
▸ IDO1 P14902 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ LMNA P02545 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
SCHEMBL23809423 0.93 MCL1 (0.42) MCL1GRIN2BKMT2APOLB
SCHEMBL23809236 0.92 GRIN2B (0.44) MCL1GRIN2BKMT2ALMNA
SCHEMBL26581336 0.87 GRIN2B (0.50) MCL1GRIN2BPOLB
SCHEMBL20604943 0.86 GRIN2B (0.43) MCL1GRIN2BIDO1KMT2AL3MBTL1
SCHEMBL23809510 0.83 GRIN2B (0.39) MCL1GRIN2B
SCHEMBL26581555 0.80 MCL1 (0.46) MCL1GRIN2BKMT2A
SCHEMBL20604762 0.80 MCL1 (0.43) MCL1GRIN2BKMT2APOLB
SCHEMBL20605060 0.79 GRIN2B (0.49) GRIN2B
SCHEMBL26581333 0.79 GRIN2B (0.52) MCL1GRIN2BKMT2ALMNA
SCHEMBL23809455 0.78 DRD2 (0.38) MCL1

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 MCL1 1/4885GRIN2B 3904/4885IDO1 253/4885

“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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