SCHEMBL7331850

SCHEMBL7331850

CCCOCCCCCCCCCCC[O]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.44
MEN1 O00255 1/20 0.44
THRB P10828 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 1/20 0.44
CES2 O00748 2/20 0.41
USP2 O75604 1/20 0.39
TSHR P16473 2/20 0.39
CYP3A4 P08684 1/20 0.38
LPAR5 Q9H1C0 1/20 0.36
SPHK2 Q9NRA0 1/20 0.36
EPHX2 P34913 3/20 0.36
ALDH1A1 P00352 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
LPAR1 Q92633 2/20 0.33
LPAR3 Q9UBY5 2/20 0.33
LPAR2 Q9HBW0 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33

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
SCHEMBL2528897 1.00 HTT (0.44) HTTMEN1THRBKMT2AMAPT
SCHEMBL7339372 1.00 HTT (0.44) HTTMEN1THRBKMT2AMAPT
SCHEMBL7335022 1.00 HTT (0.44) HTTMEN1THRBKMT2AMAPT
SCHEMBL7339878 1.00 HTT (0.44) HTTMEN1THRBKMT2AMAPT
SCHEMBL1309393 1.00 HTT (0.44) HTTMEN1THRBKMT2AMAPT
SCHEMBL8813008 0.97 HTT (0.43) HTTMEN1THRBKMT2AMAPT
SCHEMBL712086 0.97
SCHEMBL4401716 0.97 HTT (0.41) HTTMEN1THRBKMT2AMAPT
SCHEMBL5479929 0.97 HTT (0.41) HTTMEN1THRBKMT2AMAPT
SCHEMBL4390851 0.95 HTT (0.44) HTTMEN1THRBKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6265536-B1 MICROBIOCIDE AND FUNGICIDE WHICH IS INHIBITOR OF BETA-1,3-GLUCAN SYNTHASE; TREATMENT OF PNEUMOCYSTIS CARINII INFECTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-07-24 US disclosed
US-6107458-A FUNGICIDE WHICH IS BETA-1,3-GLYCAN SYNTHASE INHIBITOR; FOR PROPHYLAXIS AND TREATMENT OF PNEUMOCYSTIS CARINII INFECTIONS LIKE PNEUMONIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-08-22 US disclosed
EP-0788511-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-08-13 EP disclosed
WO-1996011210-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-04-18 WO disclosed