SCHEMBL23167435

SCHEMBL23167435

CC(C)(C)OC(=O)N[C@H]1C[C@@H](CN2C(=O)c3ccccc3C2=O)N(Cc2ccccc2)C1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ BRD4 O60885 2/20 0.42
▸ KDM1A O60341 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ KCNA3 P22001 1/20 0.40
▸ DRD2 P14416 3/20 0.39
▸ EPHX2 P34913 1/20 0.38
▸ AKT1 P31749 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ UBE2M P61081 1/20 0.36
▸ DCUN1D1 Q96GG9 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36

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
SCHEMBL21973186 0.85 KMT2A (0.44) KMT2AL3MBTL1AKT1ALDH1A1MEN1
SCHEMBL30835192 0.85 KMT2A (0.44) KMT2AL3MBTL1AKT1ALDH1A1MEN1
SCHEMBL21166309 0.84 KMT2A (0.59) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL28352519 0.83 KMT2A (0.58) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL13841915 0.80 KMT2A (0.61) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL8869835 0.80 KMT2A (0.61) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL2821018 0.80 KMT2A (0.61) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL9308794 0.80 KMT2A (0.61) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL8566009 0.80 KMT2A (0.61) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL16022317 0.80 KMT2A (0.61) KMT2AL3MBTL1KDM1AMAOBKCNA3

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-20210094912-A1 INDOLE DERIVATIVES AS EFFLUX PUMP INHIBITORS RUTGERS, THE STATE UNIVERISTY OF NEW JERSEY (US) 2021-04-01 — — 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-20210094912-A1 INDOLE DERIVATIVES AS EFFLUX PUMP INHIBITORS ABCB11, ABCB1, ABCG2 KMT2A 4541/4885L3MBTL1 4699/4885BRD4 1872/4885

“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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