SCHEMBL6870929

SCHEMBL6870929

Fc1ccc(Cn2cc(C3CCN(Cc4ccco4)CC3)c3ccccc32)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 6/20 0.61
SLC5A1 P13866 2/20 0.53
SLC5A2 P31639 2/20 0.53
HTR2A P28223 3/20 0.48
HTR2C P28335 3/20 0.48
HTR2B P41595 3/20 0.48
DRD2 P14416 1/20 0.48
HTR6 P50406 1/20 0.48
CNR2 P34972 1/20 0.48
NPSR1 Q6W5P4 2/20 0.45
ALDH1A1 P00352 1/20 0.45
ALOX12 P18054 1/20 0.45
MAPT P10636 1/20 0.45
MAPK1 P28482 1/20 0.45
PTBP1 P26599 1/20 0.45
SLC2A1 P11166 1/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
HPGD P15428 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL6779928 0.82 HRH2 (0.54) HRH2SLC5A1SLC5A2HTR2AHTR2C
SCHEMBL6872329 0.79 DRD2 (0.50) HRH2SLC5A1SLC5A2HTR2AHTR2C
SCHEMBL6780420 0.78 DRD2 (0.59) HRH2SLC5A1SLC5A2HTR2AHTR2C
SCHEMBL27494197 0.77 ALDH1A1 (0.59) HRH2SLC5A1SLC5A2DRD2HTR6
SCHEMBL5341713 0.77 HRH2 (0.73) HRH2HTR2AHTR2CHTR2BDRD2
SCHEMBL5340949 0.76 HRH2 (1.00) HRH2HTR2AHTR2CHTR2B
SCHEMBL6777121 0.76 DRD2 (0.62) HRH2SLC5A1SLC5A2HTR2AHTR2C
SCHEMBL5355591 0.76 HRH2 (0.56) HRH2SLC5A1SLC5A2HTR2AHTR2C
SCHEMBL27493414 0.76 SLC5A1 (0.56) SLC5A1SLC5A2DRD2HTR6CNR2
SCHEMBL27581380 0.76 HRH2 (0.58) HRH2DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1183251-B1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA SA (ES) 2004-02-11 EP disclosed