SCHEMBL1381809

SCHEMBL1381809

O=S(=O)(Nc1cccc(OCc2ccccc2)c1)c1ccc(N2CCNCC2)c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 11/20 0.49
HTR1A P08908 4/20 0.47
SLC6A2 P23975 3/20 0.47
SLC6A4 P31645 3/20 0.47
SLC6A3 Q01959 2/20 0.47
FABP4 P15090 3/20 0.44
HTR1D P28221 1/20 0.43
HTR1B P28222 1/20 0.43
HTR2A P28223 1/20 0.43
PRMT5 O14744 1/20 0.42
F10 P00742 1/20 0.41
ALOX5 P09917 1/20 0.41

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
SCHEMBL1378343 0.83 HTR6 (0.51) HTR6FABP4
SCHEMBL1381741 0.83 SLC22A12 (0.53) HTR6HTR1AFABP4HTR1DHTR1B
SCHEMBL30735820 0.82 HTR6 (0.66) HTR6HTR1AHTR1DHTR1BHTR2A
SCHEMBL3609792 0.82 HTR6 (0.66) HTR6HTR1AHTR1DHTR1BHTR2A
Hydrochloric Acid SCHEMBL6047103 0.82 HTR6 (0.50) HTR6FABP4
SCHEMBL4313175 0.82 HTR6 (0.57) HTR6HTR1AHTR1DHTR1BHTR2A
Hydrochloric Acid SCHEMBL6047117 0.81 HTR6 (0.64) HTR6HTR1AHTR1DHTR1BHTR2A
Hydrochloric Acid SCHEMBL27603115 0.80 HTR6 (0.55) HTR6HTR1AHTR1DHTR1BHTR2A
SCHEMBL1380667 0.80 HTR6 (0.48) HTR6FABP4
SCHEMBL1379250 0.80 HTR6 (0.58) HTR6

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
JP-4731114-B2 2011-07-20 JP claimed