SCHEMBL5755950

SCHEMBL5755950

O=S(=O)(c1ccccc1)N(CCCN1CCC(Cc2ccccc2)CC1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.54
SIGMAR1 Q99720 2/20 0.54
CCR5 P51681 1/20 0.53
HTR7 P34969 1/20 0.53
KCNH2 Q12809 1/20 0.52
OPRM1 P35372 3/20 0.52
SLC6A2 P23975 1/20 0.51
SLC6A4 P31645 1/20 0.51
TMEM97 Q5BJF2 1/20 0.51
HRH3 Q9Y5N1 1/20 0.50
GRIN2A Q12879 1/20 0.50
GRIN2B Q13224 1/20 0.50
PRMT3 O60678 1/20 0.50
CARM1 Q86X55 1/20 0.50
PRMT6 Q96LA8 1/20 0.50
PRMT1 Q99873 1/20 0.50
PRMT8 Q9NR22 1/20 0.50

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
SCHEMBL5757610 0.92 OPRM1 (0.55) CCR3SIGMAR1CCR5HTR7KCNH2
SCHEMBL5758268 0.87 CCR5 (0.57) CCR3SIGMAR1CCR5KCNH2OPRM1
SCHEMBL5754882 0.86 MEN1 (0.57) CCR3SIGMAR1CCR5HTR7SLC6A2
SCHEMBL5758216 0.85 ALDH1A1 (0.57) CCR3SIGMAR1CCR5KCNH2OPRM1
SCHEMBL5754009 0.82 KMT2A (0.49) CCR3SIGMAR1CCR5OPRM1SLC6A2
SCHEMBL5759445 0.81 CCR5 (0.47) CCR3SIGMAR1CCR5KCNH2OPRM1
SCHEMBL5863848 0.80 CCR3 (0.53) CCR3SIGMAR1KCNH2OPRM1HRH3
SCHEMBL5757056 0.80 KCNH2 (0.56) HTR7KCNH2HRH3
SCHEMBL5758878 0.79 GRIN2B (0.50) CCR5HTR7SLC6A2SLC6A4TMEM97
SCHEMBL5757906 0.78 KCNH2 (0.63) CCR3SIGMAR1CCR5KCNH2OPRM1

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