SCHEMBL5757908

SCHEMBL5757908

CNCCC(c1ccccc1)N1CCC(Cc2ccccc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 4/20 0.59
PRMT6 Q96LA8 4/20 0.59
GRIN2B Q13224 6/20 0.48
ADRA2A P08913 5/20 0.48
HTR2A P28223 5/20 0.48
ADRA1A P35348 5/20 0.48
GRIN1 Q05586 4/20 0.48
HTR2B P41595 4/20 0.48
SIGMAR1 Q99720 3/20 0.48
GRIN2D O15399 2/20 0.48
HTR1A P08908 2/20 0.48
GRIN2A Q12879 2/20 0.48
GRIN2C Q14957 2/20 0.48
SLC6A2 P23975 2/20 0.48
SLC6A3 Q01959 2/20 0.48
LMNA P02545 1/20 0.48
ADRB1 P08588 1/20 0.48
DRD2 P14416 1/20 0.48
ADRA2B P18089 1/20 0.48
ADRA2C P18825 1/20 0.48

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
SCHEMBL7405479 0.85 OPRK1 (0.52) GRIN2BADRA2AHTR2AADRA1AGRIN1
SCHEMBL5758271 0.84 CCR5 (0.52) CARM1PRMT6GRIN2BADRA2AHTR2A
SCHEMBL5757825 0.84 SLC6A2 (0.54) GRIN2BGRIN1SLC6A2SLC6A3KCNH2
SCHEMBL5755428 0.84 SLC6A2 (0.47) CARM1PRMT6GRIN2BADRA2AHTR2A
SCHEMBL5759913 0.82 PRMT3 (0.56) CARM1PRMT6GRIN2BADRA2AHTR2A
SCHEMBL5756621 0.82 GRIN2B (0.48) GRIN2BADRA2AHTR2AADRA1AGRIN1
Hydrochloric Acid SCHEMBL5756735 0.81 PRMT3 (0.55) CARM1PRMT6GRIN2BADRA2AHTR2A
SCHEMBL5755953 0.81 CCR5 (0.49) SLC6A2SLC6A3LMNAMEN1KMT2A
SCHEMBL5758650 0.81 CCR3 (0.60) SLC6A2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL5757613 0.79 MEN1 (0.51) LMNAOPRK1CYP1A2CYP3A4MEN1

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