SCHEMBL4635974

SCHEMBL4635974

CC(c1ccc(Cl)c(Cl)c1)N(C)CCC#N

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 8/20 0.40
SLC6A3 Q01959 8/20 0.39
SLC6A2 P23975 7/20 0.39
SIGMAR1 Q99720 1/20 0.38
ALDH1A1 P00352 3/20 0.37
LMNA P02545 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL4719157 0.78 SLC6A4 (0.39) SLC6A4SLC6A3SLC6A2SIGMAR1ALDH1A1
SCHEMBL4668444 0.77 SLC6A4 (0.40) SLC6A4SLC6A3SLC6A2SIGMAR1ALDH1A1
SCHEMBL4719154 0.74 SIGMAR1 (0.50) SIGMAR1ALDH1A1CYP2D6KDM4EKMT2A
SCHEMBL4868499 0.72 ALDH1A1 (0.51) SLC6A4SLC6A3SLC6A2SIGMAR1ALDH1A1
SCHEMBL9491754 0.70 SLC6A3 (0.46) SLC6A4SLC6A3SLC6A2ALDH1A1LMNA
Hydrochloric Acid SCHEMBL10839428 0.70 KCNH2 (0.60) SLC6A4SLC6A3SLC6A2CYP2D6
SCHEMBL2543003 0.69 PYCR1 (0.58) SLC6A4SLC6A3SLC6A2SIGMAR1ALDH1A1
SCHEMBL8565602 0.69 SLC6A3 (0.39) SLC6A4SLC6A3SLC6A2ALDH1A1LMNA
SCHEMBL16650034 0.68 SLC6A3 (0.41) SLC6A4SLC6A3SLC6A2ALDH1A1LMNA
SCHEMBL4637181 0.68 SIGMAR1 (0.67) SIGMAR1ALDH1A1CYP3A4CYP2D6KMT2A

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-20080287434-A1 New amino-alkyl-amide derivatives as CCR3 receptor ligands SANOFI-AVENTIS (FR) 2008-11-20 US disclosed
EP-1931620-A1 AMINO-ALKYL-AMIDE DERIVATIVES AS CCR3 RECEPTOR LIQUIDS Sanofi-Aventis (FR) 2008-06-18 EP disclosed
WO-2007034252-A1 AMINO-ALKYL-AMIDE DERIVATIVES AS CCR3 RECEPTOR LIQUIDS SANOFI-AVENTIS (FR) 2007-03-29 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-20080287434-A1 New amino-alkyl-amide derivatives as CCR3 receptor ligands CCR3, CCR1, CCR4 SLC6A4 3538/4885SLC6A3 2734/4885SLC6A2 3977/4885

“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.