SCHEMBL7629985

SCHEMBL7629985

Cc1ccc(C(=O)OOC(=O)OCCC(CCOC(=O)OOC(=O)c2ccc(C)cc2)COC(=O)OOC(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
ADRB3 P13945 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
RAB9A P51151 4/20 0.39
ALDH1A1 P00352 3/20 0.39
NPC1 O15118 2/20 0.39
MAPT P10636 2/20 0.39
HSD17B10 Q99714 2/20 0.39
PKM P14618 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 2/20 0.37
GAA P10253 1/20 0.37
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ESR1 P03372 1/20 0.35
CA7 P43166 1/20 0.35

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
SCHEMBL7631414 0.89 ADRB2 (0.42) ADRB2ADRB1ADRB3TDP1RAB9A
SCHEMBL7634343 0.87 ALDH1A1 (0.40) TDP1ALDH1A1MAPTHSD17B10PKM
SCHEMBL7633460 0.86 HSD17B10 (0.40) ADRB2ADRB1ADRB3RAB9AALDH1A1
SCHEMBL7627039 0.86 CA1 (0.45) ADRB2ADRB1ADRB3RAB9AALDH1A1
SCHEMBL7632376 0.86 KMT2A (0.36) TDP1ALDH1A1PKMMAPK1KMT2A
SCHEMBL7625507 0.85 LMNA (0.52) ADRB2ADRB1ADRB3TDP1ALDH1A1
SCHEMBL7629633 0.85 CA1 (0.39) TDP1RAB9AALDH1A1NPC1MAPT
SCHEMBL7634823 0.85 ADRB2 (0.39) ADRB2ADRB1ADRB3TDP1RAB9A
SCHEMBL7632766 0.85 MAPK1 (0.36) TDP1ALDH1A1MAPTHSD17B10PKM
SCHEMBL7629425 0.85 PKM (0.38) RAB9AALDH1A1MAPTHSD17B10PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1233014-A1 ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME NOF CORPORATION (JP) 2002-08-21 EP disclosed