SCHEMBL5758650

SCHEMBL5758650

O=C(NCCC(c1ccccc1)N1CCC(Cc2ccccc2)CC1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 3/20 0.60
SLC6A2 P23975 6/20 0.56
SLC6A4 P31645 4/20 0.56
SLC6A3 Q01959 2/20 0.53
TMEM97 Q5BJF2 2/20 0.53
ACHE P22303 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
EPHX2 P34913 1/20 0.51
CHRM4 P08173 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
SCHEMBL5757825 0.87 SLC6A2 (0.54) SLC6A2SLC6A3MEN1KMT2A
SCHEMBL5754847 0.84 EPHX2 (0.53) CCR3ACHEMEN1KMT2AEPHX2
SCHEMBL5757908 0.81 CARM1 (0.59) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL7497930 0.80 CCR3 (0.61) CCR3MEN1KMT2A
SCHEMBL5755428 0.80 SLC6A2 (0.47) CCR3SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL7499307 0.79 EPHX2 (0.55) CCR3SLC6A2SLC6A3EPHX2
SCHEMBL5758376 0.79 SIGMAR1 (0.49) CCR3SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL5758271 0.78 CCR5 (0.52) SLC6A2SLC6A4SLC6A3
SCHEMBL5755953 0.77 CCR5 (0.49) SLC6A2SLC6A3MEN1KMT2A
SCHEMBL5759913 0.76 PRMT3 (0.56) CCR3SLC6A2SLC6A4SLC6A3MEN1

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