SCHEMBL6545765

SCHEMBL6545765

O=C(O)/C=C/C(=O)Nc1cccc(O)c1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR2 Q9HBW0 2/20 0.80
LPAR1 Q92633 1/20 0.80
MMP1 P03956 5/20 0.69
MMP2 P08253 5/20 0.69
MMP9 P14780 5/20 0.69
CREBBP Q92793 1/20 0.67
ALDH1A1 P00352 6/20 0.65
MAPT P10636 4/20 0.65
PARP1 P09874 2/20 0.65
PARP15 Q460N3 2/20 0.65
PARP14 Q460N5 2/20 0.65
PARP10 Q53GL7 2/20 0.65
LPAR3 Q9UBY5 2/20 0.65
TDP2 O95551 1/20 0.64
GAA P10253 1/20 0.64
THRB P10828 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
MEN1 O00255 1/20 0.58
NPC1 O15118 1/20 0.58
PKM P14618 1/20 0.58

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
SCHEMBL7457467 1.00 LPAR2 (0.80) LPAR2LPAR1MMP1MMP2MMP9
SCHEMBL6545766 1.00 LPAR2 (0.80) LPAR2LPAR1MMP1MMP2MMP9
SCHEMBL8401287 0.98 LPAR2 (0.77) LPAR2LPAR1MMP1MMP2MMP9
SCHEMBL1552033 0.89 LPAR2 (1.00) LPAR2LPAR1CREBBPALDH1A1MAPT
SCHEMBL441804 0.89 LPAR2 (1.00) LPAR2LPAR1CREBBPALDH1A1MAPT
SCHEMBL441805 0.89 LPAR2 (1.00) LPAR2LPAR1CREBBPALDH1A1MAPT
Iodide SCHEMBL1552156 0.87 LPAR2 (0.96) LPAR2LPAR1CREBBPALDH1A1MAPT
SCHEMBL7771130 0.85 MMP1 (0.65) LPAR2LPAR1MMP1MMP2MMP9
SCHEMBL8735051 0.85 MMP1 (0.65) LPAR2LPAR1MMP1MMP2MMP9
SCHEMBL11144684 0.84 ALDH1A1 (0.65) LPAR2LPAR1MMP1MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040110256-A1 Method of decomposing unsaturated carboxylic acid copolymer IDEMITSU KOSAN CO. LTD. (JP) 2004-06-10 US disclosed
EP-1382671-A1 METHOD OF DECOMPOSING UNSATURATED CARBOXYLIC ACID COPOLYMER IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2004-01-21 EP disclosed