SCHEMBL4645067

SCHEMBL4645067

[CH2]CC(=O)Oc1ccc(OCC)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.54
PARP10 Q53GL7 1/20 0.52
KMT2A Q03164 6/20 0.50
MEN1 O00255 2/20 0.50
LMNA P02545 2/20 0.49
NPC1 O15118 1/20 0.49
PLK1 P53350 1/20 0.49
POLB P06746 1/20 0.49
CYP1A2 P05177 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ALDH1A1 P00352 1/20 0.47
PLA2G4B P0C869 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ESR1 P03372 1/20 0.46
RECQL P46063 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HIF1A Q16665 1/20 0.46
LTA4H P09960 1/20 0.46

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
SCHEMBL4646736 0.85 KMT2A (0.55) NQO1PARP10KMT2AMEN1LMNA
SCHEMBL4642148 0.85 PTGS2 (0.41) NQO1PARP10KMT2AMEN1LMNA
SCHEMBL4647638 0.84 KMT2A (0.54) NQO1PARP10KMT2AMEN1LMNA
SCHEMBL4642336 0.82 NQO1 (0.56) NQO1PARP10KMT2AMEN1LMNA
SCHEMBL4644441 0.81 ALDH1A1 (0.54) NQO1PARP10KMT2AMEN1LMNA
SCHEMBL20703605 0.81 BCL9 (0.60) NQO1PARP10KMT2AMEN1LMNA
SCHEMBL4642021 0.80 PARP10 (0.60) NQO1PARP10KMT2AMEN1LMNA
SCHEMBL4644471 0.80 LMNA (0.56) KMT2AMEN1LMNACYP1A2TDP1
SCHEMBL3419802 0.79 NQO1 (0.64) NQO1PARP10KMT2AMEN1LMNA
SCHEMBL4648056 0.79 KMT2A (0.56) NQO1PARP10KMT2AMEN1LMNA

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