SCHEMBL1085050

SCHEMBL1085050

Cc1c(Br)cccc1C(=O)N1CCC(N2CCCC2)CC1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL3 Q96JM7 18/20 0.76
▸ L3MBTL1 Q9Y468 14/20 0.76
▸ TP53BP1 Q12888 4/20 0.68
▸ MBTD1 Q05BQ5 8/20 0.60
▸ MEN1 O00255 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ L3MBTL4 Q8NA19 2/20 0.57

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
SCHEMBL23682962 0.86 L3MBTL3 (1.00) L3MBTL3L3MBTL1TP53BP1MBTD1MEN1
SCHEMBL16344196 0.86 GAA (0.59) L3MBTL3L3MBTL1MEN1KMT2A
SCHEMBL2376640 0.77 L3MBTL1 (0.55) L3MBTL1MEN1KMT2A
SCHEMBL1085344 0.76 L3MBTL3 (0.72) L3MBTL3L3MBTL1TP53BP1MBTD1L3MBTL4
SCHEMBL2375485 0.76 ALDH1A1 (0.55) L3MBTL1KMT2A
SCHEMBL4489212 0.75 L3MBTL3 (0.80) L3MBTL3L3MBTL1TP53BP1MBTD1MEN1
SCHEMBL27223857 0.75 L3MBTL3 (1.00) L3MBTL3L3MBTL1TP53BP1MBTD1L3MBTL4
SCHEMBL29613449 0.75 L3MBTL3 (1.00) L3MBTL3L3MBTL1TP53BP1MBTD1L3MBTL4
SCHEMBL1083720 0.74 L3MBTL3 (0.53) L3MBTL3L3MBTL1TP53BP1MBTD1MEN1
SCHEMBL2379156 0.74 CNR1 (0.51) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153805-B2 Biaryl derivatives HOFFMANN-LA ROCHE INC. (US) 2012-04-10 — — US disclosed
EP-2205583-A2 N-HETEROCYCLIC BIARYL CARBOXAMIDES AS CCR RECEPTOR ANTAGONISTS F. Hoffmann-Roche AG (CH) 2010-07-14 — — EP disclosed
WO-2009043747-A2 N-HETEROCYCLIC BIARYL CARBOXAMIDES AS CCR RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-04-09 — — WO disclosed
US-20090048238-A1 NOVEL BIARYL DERIVATIVES HOFFMANN-LA ROCHE, INC. 2009-02-19 — — 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-20090048238-A1 NOVEL BIARYL DERIVATIVES CCR3, CCRL2, CCR2 L3MBTL3 1629/4885L3MBTL1 2710/4885TP53BP1 4816/4885

“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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