SCHEMBL4643607

SCHEMBL4643607

[CH2]CC(=O)OC(=O)Cc1ccc(OC)c(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.53
RIN1 Q13671 1/20 0.53
LMNA P02545 4/20 0.52
HTT P42858 4/20 0.52
NPC1 O15118 1/20 0.52
GAA P10253 6/20 0.52
ALDH1A1 P00352 4/20 0.52
MAPT P10636 3/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C19 P33261 1/20 0.52
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
HPGD P15428 1/20 0.51
CA5A P35218 1/20 0.51
GLA P06280 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
TSHR P16473 1/20 0.50
NFKB1 P19838 1/20 0.50
TDP1 Q9NUW8 1/20 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
SCHEMBL4646145 0.88 ABL1 (0.51) ABL1RIN1LMNAHTTNPC1
SCHEMBL4643462 0.86 ABL1 (0.55) ABL1RIN1LMNAHTTNPC1
SCHEMBL4641805 0.85 ABL1 (0.52) ABL1RIN1LMNAHTTNPC1
SCHEMBL4643466 0.84 ABL1 (0.56) ABL1RIN1LMNAHTTNPC1
SCHEMBL29626821 0.82 ALDH1A1 (0.62) ABL1RIN1LMNAHTTNPC1
SCHEMBL198282 0.82 ALDH1A1 (0.62) ABL1RIN1LMNAHTTNPC1
SCHEMBL4643603 0.80 LMNA (0.52) ABL1RIN1LMNAHTTNPC1
SCHEMBL153055 0.80 GAA (0.74) LMNAHTTNPC1GAAALDH1A1
SCHEMBL30049382 0.80 GAA (0.74) LMNAHTTNPC1GAAALDH1A1
SCHEMBL4642521 0.79 KMT2A (0.55) HTTNPC1GAAALDH1A1MAPT

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