SCHEMBL5016041

SCHEMBL5016041

CC(C)CCN1CCC(NCc2ccc(Br)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 10/20 0.57
▸ BACE1 P56817 10/20 0.57
▸ BCHE P06276 8/20 0.57
▸ CARM1 Q86X55 5/20 0.51
▸ PRMT6 Q96LA8 5/20 0.51
▸ PRMT8 Q9NR22 1/20 0.51
▸ FPR3 P25089 1/20 0.47
▸ FPR2 P25090 1/20 0.47
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45

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
SCHEMBL20492779 0.86 CARM1 (0.68) ACHEBACE1BCHECARM1PRMT6
SCHEMBL5011629 0.83 CARM1 (0.48) ACHEBACE1BCHECARM1PRMT6
SCHEMBL16538645 0.80 HRH3 (0.63) ACHEBACE1BCHECARM1PRMT6
SCHEMBL6245902 0.79 CARM1 (0.44) ACHEBACE1BCHECARM1PRMT6
SCHEMBL5016061 0.78 CARM1 (0.54) ACHEBACE1BCHECARM1PRMT6
SCHEMBL1241255 0.75 RAB9A (0.58) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL5014997 0.75 TP53 (0.43) ACHEBACE1BCHECARM1PRMT6
SCHEMBL3318786 0.75 ROCK1 (0.45) CARM1PRMT6PRMT8
SCHEMBL16055288 0.75 ACHE (0.85) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL23560251 0.74 CARM1 (0.36) BACE1CARM1PRMT6PRMT8FPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080076762-A1 Novel 4-Aminopiperidine Derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2008-03-27 — — US disclosed
EP-1824822-A2 NOVEL 4-AMINOPIPERIDINE DERIVATIVES AS PLASMEPSIN II INHIBITORS Actelion Pharmaceuticals Ltd. (CH) 2007-08-29 — — EP disclosed
WO-2006056930-A2 NOVEL 4 -AMINOPIPERIDINE DERIVATIVES AS PLASMEPSIN II INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2006-06-01 — — WO 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-20080076762-A1 Novel 4-Aminopiperidine Derivatives METAP1, DNPEP, PEPD ACHE 119/4885BACE1 191/4885BCHE 709/4885

“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.

Send feedback