SCHEMBL4643603

SCHEMBL4643603

C[CH]C(=O)OC(=O)Cc1ccc(OC)c(OC)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.52
HTT P42858 4/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
ABL1 P00519 1/20 0.52
RIN1 Q13671 1/20 0.52
NPC1 O15118 1/20 0.51
GAA P10253 4/20 0.51
MAPT P10636 3/20 0.51
ALDH1A1 P00352 3/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C19 P33261 1/20 0.51
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
HPGD P15428 1/20 0.50
GLA P06280 1/20 0.50
LDHA P00338 1/20 0.49
PKM P14618 1/20 0.48
CACNA1B Q00975 1/20 0.48
APBA1 Q02410 1/20 0.48

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
SCHEMBL4646142 0.85 ABL1 (0.50) LMNAHTTSMN1; SMN2ABL1RIN1
SCHEMBL4645870 0.84 ABL1 (0.52) LMNAHTTSMN1; SMN2ABL1RIN1
SCHEMBL4641802 0.83 ABL1 (0.48) LMNAHTTSMN1; SMN2ABL1RIN1
SCHEMBL4643466 0.83 ABL1 (0.56) LMNAHTTSMN1; SMN2ABL1RIN1
SCHEMBL4641884 0.82 ABL1 (0.53) LMNAHTTSMN1; SMN2ABL1RIN1
SCHEMBL4643462 0.81 ABL1 (0.55) LMNAHTTSMN1; SMN2ABL1RIN1
SCHEMBL29626821 0.80 ALDH1A1 (0.62) LMNAHTTSMN1; SMN2ABL1RIN1
SCHEMBL198282 0.80 ALDH1A1 (0.62) LMNAHTTSMN1; SMN2ABL1RIN1
SCHEMBL4643607 0.80 ABL1 (0.53) LMNAHTTSMN1; SMN2ABL1RIN1
SCHEMBL4645733 0.80 ABL1 (0.51) LMNAHTTSMN1; SMN2ABL1RIN1

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