SCHEMBL5017430

SCHEMBL5017430

CCCCOc1ccc(C(=O)NCC2(N(C)C)CCCCC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 6/20 1.00
THRB P10828 1/20 0.67
TP53 P04637 3/20 0.66
OPRM1 P35372 1/20 0.65
OPRD1 P41143 1/20 0.65
CRHBP P24387 1/20 0.64
CRHR2 Q13324 1/20 0.64
ALDH1A1 P00352 2/20 0.55
LMNA P02545 2/20 0.55

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
SCHEMBL16233245 0.88 SLC6A5 (0.79) SLC6A5THRBTP53OPRM1OPRD1
SCHEMBL16233174 0.88 SLC6A5 (0.79) SLC6A5THRBTP53OPRM1OPRD1
SCHEMBL5015969 0.81 SLC6A5 (1.00) SLC6A5THRBTP53OPRM1OPRD1
SCHEMBL16233241 0.80 TP53 (1.00) SLC6A5THRBTP53OPRM1CRHBP
SCHEMBL5015981 0.79 SLC6A5 (1.00) SLC6A5THRBTP53CRHBPCRHR2
SCHEMBL5015977 0.79 OPRM1 (0.74) SLC6A5THRBTP53OPRM1OPRD1
SCHEMBL8285579 0.78 SLC6A5 (0.64) SLC6A5TP53ALDH1A1LMNA
SCHEMBL5024761 0.77 OPRM1 (0.72) SLC6A5THRBTP53OPRM1OPRD1
SCHEMBL13754058 0.75 MMP1 (0.70) SLC6A5ALDH1A1LMNA
SCHEMBL5017447 0.74 OPRM1 (0.68) SLC6A5THRBTP53OPRM1OPRD1

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
EP-1419138-B1 N- (1-DIMETHYLAMINOCYCLOALKYL)METHYL BENZAMIDE DERIVATIVES ORGANON NV (NL) 2008-10-29 EP disclosed
US-7126027-B2 N-[(1-dimethylaminocycloalkyl)methyl]benzamide derivatives AKZO NOBEL N.V. (NL) 2006-10-24 US disclosed
US-20040242685-A1 N-[(1-dimethylaminocycloalkyl)methyl]benzamide derivatives N.V. ORGANON (NL) 2004-12-02 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-20040242685-A1 N-[(1-dimethylaminocycloalkyl)methyl]benzamide derivatives SLC1A2, SLC6A1, KCNT2 SLC6A5 26/4885THRB 2336/4885TP53 4820/4885

“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.