SCHEMBL3137141

SCHEMBL3137141

Cc1[nH]c2ccccc2c1CC(=O)NCCC1CCN(Cc2ccccc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 7/20 1.00
▸ BCHE P06276 6/20 1.00
▸ KDM4E B2RXH2 1/20 0.62
▸ MEN1 O00255 1/20 0.62
▸ ALDH1A1 P00352 1/20 0.62
▸ MAPT P10636 1/20 0.62
▸ HTT P42858 1/20 0.62
▸ KMT2A Q03164 1/20 0.62
▸ CHRM4 P08173 2/20 0.56

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
SCHEMBL3146771 0.80 BCHE (1.00) ACHEBCHECHRM4
SCHEMBL3155847 0.76 ACHE (1.00) ACHEBCHEKDM4ECHRM4
SCHEMBL6496336 0.75 CCR8 (0.69) ACHEBCHEKDM4EMEN1ALDH1A1
SCHEMBL429213 0.75 ACHE (0.74) ACHEBCHE
SCHEMBL3147014 0.75 BCHE (1.00) ACHEBCHECHRM4
SCHEMBL10778328 0.74 L3MBTL1 (0.60) ACHEBCHEMEN1KMT2A
SCHEMBL3157204 0.74 BCHE (1.00) ACHEBCHEMEN1KMT2ACHRM4
SCHEMBL429212 0.73 ACHE (0.74) ACHEBCHECHRM4
SCHEMBL4636524 0.73 ACHE (0.74) ACHEBCHECHRM4
SCHEMBL4636527 0.73 ACHE (0.74) ACHEBCHECHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758888-B1 BUTYRYLCHOLINESTERASE SELECTIVE INHIBITORS NEUROPHARMA S A U (ES) 2010-02-17 — — EP disclosed
US-20080119521-A1 Butyrlcholinesterase Selective Inhibitors NEUROPHARMA, S.A. (ES) 2008-05-22 — — US disclosed
US-20080119521-A1 Butyrlcholinesterase Selective Inhibitors NEUROPHARMA, S.A. (ES) 2008-05-22 — — US disclosed
US-20080119521-A1 Butyrlcholinesterase Selective Inhibitors NEUROPHARMA, S.A. (ES) 2008-05-22 — — US disclosed
CN-1960986-A Butyrylcholinesterase selective inhibitors NEUROPHARMA S A U (ES) 2007-05-09 — — CN disclosed
EP-1758888-A1 BUTYRYLCHOLINESTERASE SELECTIVE INHIBITORS Neuropharma S.A.U. (ES) 2007-03-07 — — EP disclosed
WO-2005118570-A1 BUTYRYLCHOLINESTERASE SELECTIVE INHIBITORS NEUROPHARMA, S.A. (ES) 2005-12-15 — — WO disclosed
EP-1600447-A1 Butyrylcholinesterase selective inhibitors Neuropharma S.A.U. (ES) 2005-11-30 — — EP 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-20080119521-A1 Butyrlcholinesterase Selective Inhibitors BCHE, ACHE, BACE1 ACHE 2/4885BCHE 1/4885KDM4E 774/4885

“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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