SCHEMBL7416338

SCHEMBL7416338

CC(C)OCOCCCO

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
MEN1 O00255 1/20 0.32
THRB P10828 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 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
SCHEMBL7425175 0.86 TSHR (0.48) TSHRMEN1THRBHTTKMT2A
SCHEMBL11355081 0.85
SCHEMBL7422695 0.81 TSHR (0.41) TSHRMEN1THRBHTTKMT2A
SCHEMBL188204 0.79
SCHEMBL722046 0.78 TSHR (0.42) TSHRMEN1THRBHTTKMT2A
SCHEMBL2949576 0.76 MEN1 (0.41) TSHRMEN1THRBHTTKMT2A
SCHEMBL31307045 0.76
SCHEMBL7416335 0.76
SCHEMBL2964622 0.76 MEN1 (0.41) TSHRMEN1THRBHTTKMT2A
SCHEMBL723665 0.76 HTT (0.41) TSHRMEN1THRBHTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5594006-A SUCH AS COLLEGENASE, STROMELYSIN; ANTICANCER AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-01-14 US disclosed
EP-0413544-B1 Purine derivatives, process for their preparation, pharmaceutical compositions and intermediates BEECHAM GROUP PLC (GB) 1997-01-02 EP disclosed
EP-0641323-A1 CARBOSTYRIL DERIVATIVES AS MATRIX METALLOPROTEINASES INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-03-08 EP disclosed
WO-1994021612-A1 CARBOSTYRIL DERIVATIVES AS MATRIX METALLOPROTEINASES INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-29 WO disclosed
US-5252575-A Herpes virus BEECHAM GROUP P.L.C. (GB) 1993-10-12 US disclosed
EP-0413544-A2 Purine derivatives, process for their preparation, pharmaceutical compositions and intermediates Beecham Group p.l.c. (GB) 1991-02-20 EP disclosed