SCHEMBL5758374

SCHEMBL5758374

O=C(Cc1ccc(Cl)c(Cl)c1)N(CCCN1CCC(Cc2ccccc2)CC1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 12/20 0.60
OPRM1 P35372 7/20 0.59

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
SCHEMBL5758222 0.86 OPRM1 (0.53) OPRM1
SCHEMBL5758945 0.86 KCNH2 (0.54) CCR5
SCHEMBL5758647 0.80 CCR5 (0.67) CCR5OPRM1
SCHEMBL5759395 0.80 SIGMAR1 (0.52) CCR5
SCHEMBL4777064 0.79 CCR5 (0.67) CCR5OPRM1
SCHEMBL5757823 0.79 CCR5 (0.75) CCR5OPRM1
SCHEMBL4775123 0.78 CCR5 (0.76) CCR5OPRM1
SCHEMBL4777105 0.78 CCR5 (0.84) CCR5
SCHEMBL4779024 0.77 CCR5 (0.75) CCR5
SCHEMBL6056736 0.77 CCR5 (0.55) CCR5OPRM1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1401821-A4 NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS SK CORP (KR) 2006-05-31 EP claimed
EP-1401821-A1 NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS SK Corporation (KR) 2004-03-31 EP claimed
WO-2002100848-A1 NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS SK CORPORATION (KR) 2002-12-19 WO claimed
EP-1401821-A4 NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS SK CORP (KR) 2006-05-31 EP disclosed
EP-1401821-A1 NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS SK Corporation (KR) 2004-03-31 EP disclosed
WO-2002100848-A1 NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS SK CORPORATION (KR) 2002-12-19 WO disclosed