SCHEMBL4609485

SCHEMBL4609485

COCCN1CC(c2cccc(Cl)c2)N(C2CCNCC2)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
DRD2 P14416 4/20 0.39
CCR5 P51681 3/20 0.38
KCNH2 Q12809 5/20 0.36
DRD3 P35462 3/20 0.36
GAA P10253 1/20 0.36
MAPK1 P28482 1/20 0.36
CHRNA7 P36544 1/20 0.36
CCR4 P51679 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
TP53 P04637 1/20 0.35
MDM2 Q00987 1/20 0.35
MCHR1 Q99705 1/20 0.34

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
SCHEMBL14571188 0.82 ALDH1A1 (0.40) SLC6A4SLC6A3DRD2CCR5CHRNA7
SCHEMBL4595920 0.82 STS (0.44) CCR5MAPTTP53HDAC1HDAC6
SCHEMBL5572797 0.82 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3DRD2CCR5
SCHEMBL5576527 0.80 DRD2 (0.41) DRD2CCR5KCNH2CHRNA7CCR4
SCHEMBL4598546 0.78 ALDH1A1 (0.41) SLC6A4DRD2CCR5CHRNA7ALDH1A1
SCHEMBL4607778 0.77 DRD2 (0.44) DRD2CCR5KCNH2CCR4MDM2
SCHEMBL4610004 0.76 CCR5 (0.50) CCR5KCNH2CCR4
SCHEMBL4609996 0.76 CCR5 (0.50) CCR5KCNH2CCR4
SCHEMBL5575923 0.76 ALDH1A1 (0.37) SLC6A4DRD2CCR5KCNH2CHRNA7
SCHEMBL4597271 0.75 DRD2 (0.45) SLC6A4SLC6A3DRD2CCR5KCNH2

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-1924265-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS Genzyme Corporation (US) 2008-05-28 EP disclosed
US-20070066624-A1 Chemokine receptor binding compounds ANORMED, INC. (CA) 2007-03-22 US disclosed
WO-2007022371-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS GENZYME CORPORATION (US) 2007-02-22 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-20070066624-A1 Chemokine receptor binding compounds CCR5, CCR4, CCR1 SLC6A2 3893/4885SLC6A4 2153/4885SLC6A3 2988/4885

“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.