SCHEMBL5345151

SCHEMBL5345151

c1ccc2c(c1)CNC2[C]1Oc2ccccc2O1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 4/20 0.40
DRD2 P14416 3/20 0.40
DRD4 P21917 3/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
DRD5 P21918 1/20 0.40
DRD3 P35462 1/20 0.40
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
GAA P10253 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CHRNB2 P17787 1/20 0.38
CHRNA4 P43681 1/20 0.38
PRCP P42785 1/20 0.37
OXTR P30559 1/20 0.36
MEN1 O00255 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL4614256 0.82 PRCP (0.59) GAANPSR1PRCPMEN1KMT2A
SCHEMBL6985456 0.72 PRCP (0.66) DRD1DRD2GAAPRCPMEN1
SCHEMBL31444391 0.69 CHRNB2 (0.44) GAACHRNB2CHRNA4PRCP
SCHEMBL27741885 0.67 DRD1 (0.38) DRD1DRD2DRD4ADRA2AADRA2B
SCHEMBL13963752 0.67 DRD1 (0.69) DRD1DRD2DRD4ADRA2AADRA2B
SCHEMBL13963751 0.67 DRD1 (0.69) DRD1DRD2DRD4ADRA2AADRA2B
SCHEMBL31374634 0.67 KDM1A (0.50) DRD1DRD2DRD4ADRA2AADRA2B
SCHEMBL627815 0.67 PRCP (0.49) GAACHRNB2CHRNA4PRCPMEN1
SCHEMBL537787 0.67 DRD1 (0.38) DRD1DRD2DRD4ADRA2AADRA2B
SCHEMBL31070458 0.66 SLC6A4 (0.49) DRD1DRD2DRD4ADRA2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7189741-B2 Indolylpiperidine derivatives as antihistaminic and antiallergic agents ALMIRALL PRODESFARMA S.A. (ES) 2007-03-13 US claimed
EP-1330453-B1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA SA (ES) 2006-03-29 EP claimed
US-20040116471-A1 Indolylpiperidine derivatives as antihistaminic aand antiallergic agents ALMIRALL PRODESFARMA S.A. (ES) 2004-06-17 US claimed
EP-1330453-A1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS Almirall Prodesfarma, S.A. (ES) 2003-07-30 EP claimed
WO-2002036589-A1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA S.A. (ES) 2002-05-10 WO claimed