SCHEMBL7335503

SCHEMBL7335503

CCOCCOCCCCCCCC[O]

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 1/20 0.43
EPHX2 P34913 4/20 0.40
TSHR P16473 3/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP3A4 P08684 1/20 0.37
CES2 O00748 2/20 0.35
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
GAA P10253 1/20 0.33
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32

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
SCHEMBL11222954 1.00 THRB (0.43) THRBMEN1HTTKMT2AMAPT
SCHEMBL4395126 0.97 TSHR (0.41) THRBMEN1HTTKMT2AMAPT
SCHEMBL5175314 0.95 ALDH1A1 (0.39) THRBMEN1HTTKMT2AMAPT
SCHEMBL7335579 0.95 ALDH1A1 (0.39) THRBMEN1HTTKMT2AMAPT
SCHEMBL431443 0.95 ALDH1A1 (0.39) THRBMEN1HTTKMT2AMAPT
SCHEMBL7338000 0.95 ALDH1A1 (0.39) THRBMEN1HTTKMT2AMAPT
SCHEMBL9769470 0.95 ALDH1A1 (0.39) THRBMEN1HTTKMT2AMAPT
SCHEMBL7341652 0.95 ALDH1A1 (0.39) THRBMEN1HTTKMT2AMAPT
SCHEMBL427387 0.95
SCHEMBL4393806 0.95 ALDH1A1 (0.39) THRBMEN1HTTKMT2AMAPT

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