SCHEMBL6554130

SCHEMBL6554130

CC(=O)Oc1ccc(S(=O)(=O)c2ccc(CC(C)(C)N)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.66
MAPT P10636 1/20 0.66
PKM P14618 1/20 0.66
ELANE P08246 2/20 0.53
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
CACNA1B Q00975 1/20 0.44
APBA1 Q02410 1/20 0.44
GHSR Q92847 11/20 0.43
LMNA P02545 1/20 0.41
PTGS2 P35354 1/20 0.40
SLC6A2 P23975 1/20 0.40
HTR2A P28223 1/20 0.40
SLC6A4 P31645 1/20 0.40
HRH1 P35367 1/20 0.40
HTR2B P41595 1/20 0.40
CHRNA4 P43681 1/20 0.40
SLC6A3 Q01959 1/20 0.40

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
SCHEMBL5733364 0.89 LMNA (0.50) POLBMAPTPKMELANEKMT2A
SCHEMBL6554126 0.86 POLB (0.46) POLBMAPTPKMELANEGHSR
SCHEMBL6541466 0.82 PKM (0.61) PKMSLC6A2HTR2ASLC6A4HRH1
SCHEMBL9343618 0.81 PKM (1.00) POLBMAPTPKMELANEKMT2A
SCHEMBL6540947 0.81 ALDH1A1 (0.68) ELANEKMT2AGHSRLMNA
SCHEMBL9707016 0.78 SLC6A2 (0.50) POLBMAPTELANEKMT2AMEN1
SCHEMBL25596139 0.77 BLM (0.47) POLBMAPTPKMELANEKMT2A
SCHEMBL6552730 0.77 POLB (0.66) POLBMAPTPKMELANEKMT2A
SCHEMBL12556696 0.76 LMNA (0.53) POLBMAPTPKMELANEKMT2A
SCHEMBL22033171 0.76 BLM (0.63) POLBMAPTPKMELANEKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1389185-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-02-18 EP disclosed
WO-2002094770-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-28 WO disclosed