SCHEMBL5350384

SCHEMBL5350384

CCOC(=O)N1CCC(c2cn(Cc3ccoc3)c3ccc(OC)cc23)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 6/20 0.57
HTR2C P28335 6/20 0.57
HTR2B P41595 6/20 0.57
HRH2 P25021 4/20 0.49
NOS3 P29474 1/20 0.42
NOS1 P29475 1/20 0.42
NOS2 P35228 1/20 0.42
AKR1B10 O60218 1/20 0.41
AKR1B1 P15121 1/20 0.41
KDM4E B2RXH2 4/20 0.40
ALDH1A1 P00352 4/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TSHR P16473 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PLA2G2A P14555 1/20 0.39
THRA P10827 1/20 0.39

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
SCHEMBL5352704 0.86 HTR2A (0.61) HTR2AHTR2CHTR2BHRH2KDM4E
SCHEMBL5345919 0.85 CYP1A2 (0.46) HTR2AHTR2CHTR2BHRH2NOS3
SCHEMBL5357911 0.84 TSHR (0.54) HTR2AHTR2CHTR2BHRH2NOS3
SCHEMBL5354709 0.83 HRH2 (0.64) HTR2AHTR2CHTR2BHRH2ALDH1A1
SCHEMBL5346308 0.82 HRH2 (0.53) HTR2AHTR2CHTR2BHRH2NOS3
SCHEMBL5342917 0.82 HTR2A (0.53) HTR2AHTR2CHTR2BHRH2NOS3
SCHEMBL4054407 0.81 HTR2A (0.47) HTR2AHTR2CHTR2BHRH2NOS3
SCHEMBL5347909 0.81 HTR2C (0.53) HTR2AHTR2CHTR2BHRH2ALDH1A1
SCHEMBL5344282 0.80 HTR2A (0.78) HTR2AHTR2CHTR2BHRH2
SCHEMBL5346296 0.78 HRH2 (0.48) HTR2AHTR2CHTR2BHRH2NOS3

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