SCHEMBL5757906

SCHEMBL5757906

CN(CCCN1CCC(Cc2ccccc2)CC1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.63
CCR3 P51677 2/20 0.62
SIGMAR1 Q99720 2/20 0.62
CCR5 P51681 1/20 0.59
OPRM1 P35372 3/20 0.58
SLC6A2 P23975 2/20 0.58
SLC6A4 P31645 2/20 0.58
TMEM97 Q5BJF2 1/20 0.58
PRMT6 Q96LA8 3/20 0.57
CARM1 Q86X55 2/20 0.57
PRMT3 O60678 1/20 0.57
PRMT1 Q99873 1/20 0.57
PRMT8 Q9NR22 1/20 0.57
HRH3 Q9Y5N1 1/20 0.56
GRIN2A Q12879 1/20 0.56
GRIN2B Q13224 1/20 0.56

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
SCHEMBL7411295 0.92 OPRM1 (0.64) KCNH2CCR3SIGMAR1OPRM1PRMT6
Hydrochloric Acid SCHEMBL7402387 0.90 OPRM1 (0.62) KCNH2CCR3SIGMAR1OPRM1PRMT6
SCHEMBL7405685 0.83 GRIN2B (0.59) CCR3OPRM1HRH3GRIN2AGRIN2B
Hydrochloric Acid SCHEMBL7403851 0.82 GRIN2B (0.58) CCR3OPRM1GRIN2AGRIN2B
Pimetine SCHEMBL1816328 0.81 CCR3 (0.67) KCNH2CCR3SIGMAR1OPRM1SLC6A2
SCHEMBL5757823 0.81 CCR5 (0.75) KCNH2CCR3SIGMAR1CCR5OPRM1
SCHEMBL5758268 0.81 CCR5 (0.57) KCNH2CCR3SIGMAR1CCR5OPRM1
SCHEMBL5755425 0.81 KCNH2 (0.59) KCNH2CCR3SIGMAR1CCR5OPRM1
Pimetine SCHEMBL636750 0.80 CCR3 (0.65) KCNH2CCR3SIGMAR1OPRM1PRMT6
Pimetine SCHEMBL30496149 0.80 CCR3 (0.65) KCNH2CCR3SIGMAR1OPRM1PRMT6

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