SCHEMBL4645090

SCHEMBL4645090

COc1ccc(CC(=O)C(=O)CCl)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.55
HTT P42858 3/20 0.55
NPC1 O15118 1/20 0.55
GAA P10253 3/20 0.54
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
MAPT P10636 1/20 0.54
HPGD P15428 1/20 0.54
ALDH1A1 P00352 1/20 0.53
LDHA P00338 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
CA2 P00918 3/20 0.52
NPSR1 Q6W5P4 1/20 0.51
MAPK1 P28482 1/20 0.51
EPHX2 P34913 1/20 0.51
PKM P14618 1/20 0.51
CACNA1B Q00975 1/20 0.51
APBA1 Q02410 1/20 0.51
MCL1 Q07820 1/20 0.51
CA1 P00915 2/20 0.50

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
SCHEMBL4643565 0.87 LMNA (0.52) LMNAHTTNPC1GAAKMT2A
SCHEMBL4643824 0.85 LMNA (0.56) LMNAHTTNPC1GAAKMT2A
SCHEMBL3005408 0.85 LMNA (0.56) LMNAHTTNPC1GAAKMT2A
SCHEMBL4641976 0.84 LMNA (0.50) LMNAHTTNPC1GAAKMT2A
SCHEMBL19545803 0.83 GAA (0.71) LMNAHTTNPC1GAAKMT2A
SCHEMBL4641846 0.83 LMNA (0.49) LMNAHTTNPC1GAAKMT2A
SCHEMBL6700955 0.83 LDHA (0.60) LMNAHTTNPC1GAAKMT2A
SCHEMBL4644931 0.82 LMNA (0.54) LMNAHTTNPC1GAAKMT2A
SCHEMBL11073069 0.81 ALDH1A1 (0.58) LMNAHTTNPC1GAAKMT2A
SCHEMBL76377 0.81 LMNA (0.59) LMNAHTTNPC1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed