SCHEMBL1190640

SCHEMBL1190640

CN(C)C(C)(C)C1CCN(Cc2ccccc2)C1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 8/20 0.51
▸ BCHE P06276 3/20 0.48
▸ BACE1 P56817 3/20 0.48
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ CCR3 P51677 1/20 0.46
▸ HRH1 P35367 1/20 0.46
▸ SIGMAR1 Q99720 2/20 0.44
▸ DRD2 P14416 1/20 0.44
▸ DRD4 P21917 1/20 0.44
▸ DRD3 P35462 1/20 0.44
▸ OPRM1 P35372 1/20 0.44

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
SCHEMBL12384396 0.84 ACHE (0.57) ACHEBCHEBACE1CYP1A2CYP3A4
SCHEMBL14093043 0.84 ACHE (0.57) ACHEBCHEBACE1CYP1A2CYP3A4
SCHEMBL3272029 0.82 ACHE (0.54) ACHEBCHEBACE1CYP1A2CYP3A4
SCHEMBL607895 0.82 ACHE (0.54) ACHEBCHEBACE1CYP1A2CYP3A4
SCHEMBL2485710 0.82 HRH1 (0.55) ACHEBCHEBACE1CYP1A2CYP3A4
SCHEMBL607896 0.82 ACHE (0.54) ACHEBCHEBACE1CYP1A2CYP3A4
SCHEMBL13930819 0.81 ACHE (0.53) ACHEBCHEBACE1CYP1A2CYP3A4
SCHEMBL10025921 0.80 BCHE (0.48) ACHEBCHESIGMAR1OPRM1
SCHEMBL28304830 0.78 ACHE (0.53) ACHEBCHEBACE1CYP1A2CYP3A4
SCHEMBL28304829 0.78 ACHE (0.53) ACHEBCHEBACE1CYP1A2CYP3A4

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
EP-2217226-B1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2015-07-22 — — EP disclosed
US-20130045962-A1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC 2013-02-21 — — US disclosed
US-7893056-B2 Peptide deformylase inhibitors GLAXOSMITHKLINE LLC (US) 2011-02-22 — — US disclosed
US-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC 2009-12-10 — — 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 (2 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-20130045962-A1 PEPTIDE DEFORMYLASE INHIBITORS PDF, DPEP1, DHPS ACHE 4810/4885BCHE 3988/4885BACE1 3696/4885
US-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS PDF, DHPS, PADI3 ACHE 4803/4885BCHE 3914/4885BACE1 4015/4885

“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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