SCHEMBL16496191

SCHEMBL16496191

NCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc32)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.78
USP2 O75604 1/20 0.78
ALDH1A1 P00352 1/20 0.78
CYP1A2 P05177 1/20 0.78
CHRM2 P08172 1/20 0.78
CHRM4 P08173 1/20 0.78
CHRM5 P08912 1/20 0.78
CYP2D6 P10635 1/20 0.78
CHRM1 P11229 1/20 0.78
CHRM3 P20309 1/20 0.78
GMNN O75496 1/20 0.76
APEX1 P27695 1/20 0.76

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
SCHEMBL3665228 0.99 USP2 (0.76) LMNAUSP2ALDH1A1CYP1A2CHRM2
SCHEMBL9430960 0.99 USP2 (0.76) LMNAUSP2ALDH1A1CYP1A2CHRM2
SCHEMBL3667666 0.93 LMNA (0.82) LMNAUSP2ALDH1A1CYP1A2CHRM2
SCHEMBL10971915 0.91 LMNA (0.80) LMNAUSP2ALDH1A1CYP1A2CHRM2
SCHEMBL3667503 0.89 LMNA (0.73) LMNAUSP2ALDH1A1CYP1A2CHRM2
SCHEMBL9431542 0.89 LMNA (0.83) LMNAUSP2ALDH1A1CYP1A2CHRM2
Pirenzepine SCHEMBL9254860 0.88 LMNA (1.00) LMNAUSP2ALDH1A1CYP1A2CHRM2
Pirenzepine SCHEMBL30553045 0.88 LMNA (1.00) LMNAUSP2ALDH1A1CYP1A2CHRM2
Pirenzepine SCHEMBL29793172 0.88 LMNA (1.00) LMNAUSP2ALDH1A1CYP1A2CHRM2
Pirenzepine SCHEMBL41705 0.88 LMNA (1.00) LMNAUSP2ALDH1A1CYP1A2CHRM2

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-20110300116-A1 Method for Generating a Recombinant Clonal Cell Line and Novel Reagents for Use in the Method CELLAURA TECHNOLOGIES LTD (GB) 2011-12-08 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-20110300116-A1 Method for Generating a Recombinant Clonal Cell Line and Novel Reagents for Use in the Method HAVCR2, LDLR, ADGRF1 LMNA 2037/4885USP2 3321/4885ALDH1A1 3246/4885

“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.