SCHEMBL4641806

SCHEMBL4641806

COc1ccc(Cl)c(OC(=O)CCCCCl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.43
MAPT P10636 5/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 3/20 0.39
TP53 P04637 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
LMNA P02545 3/20 0.38
HTT P42858 2/20 0.38
HSD17B10 Q99714 2/20 0.38
EGFR P00533 1/20 0.38
ERBB2 P04626 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
PKM P14618 1/20 0.38
PABPC1 P11940 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL4646842 0.96 TDP1 (0.44) TDP1MAPTKMT2AMEN1ALDH1A1
SCHEMBL4647220 0.90 TDP1 (0.49) TDP1MAPTKMT2AALDH1A1TP53
SCHEMBL4644809 0.89 TDP1 (0.43) TDP1MAPTKMT2AMEN1ALDH1A1
SCHEMBL4644306 0.87 TOP2A (0.48) KMT2AALDH1A1LMNAHTTHSD17B10
SCHEMBL4641848 0.87 TDP1 (0.44) TDP1MAPTKMT2AMEN1ALDH1A1
SCHEMBL4645456 0.86 TDP1 (0.43) TDP1MAPTKMT2AMEN1ALDH1A1
SCHEMBL4641814 0.84 TDP1 (0.46) TDP1MAPTKMT2AALDH1A1TP53
SCHEMBL4642607 0.84 MTNR1A (0.48) TDP1MAPTKMT2AMEN1ALDH1A1
SCHEMBL4642142 0.83 CA12 (0.49) MAPTKMT2AALDH1A1TP53LMNA
SCHEMBL4641715 0.83 TDP1 (0.45) TDP1MAPTKMT2AALDH1A1TP53

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