SCHEMBL7635474

SCHEMBL7635474

O=C(OO[C]1CCCC1)c1cccc(-c2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
KMO O15229 1/20 0.49
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
HDAC8 Q9BY41 1/20 0.45
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA3 P34903 1/20 0.43
F2 P00734 1/20 0.43
LMNA P02545 1/20 0.43
GALR1 P47211 1/20 0.42
ERCC5 P28715 1/20 0.42
FEN1 P39748 1/20 0.42
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
BRD4 O60885 1/20 0.40

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
SCHEMBL7623948 0.98 MAPT (0.48) MAPTTDP1KMONPC1RAB9A
SCHEMBL7623952 0.98 MAPT (0.48) MAPTTDP1KMONPC1RAB9A
SCHEMBL7629907 0.86 PDCD1 (0.47) MAPTNPC1RAB9AF2LMNA
SCHEMBL7632142 0.85 F2 (0.59) MAPTTDP1F2LMNA
SCHEMBL7625023 0.84 SLC6A2 (0.47) MAPTNPC1RAB9AF2LMNA
SCHEMBL7630420 0.84 SLC6A2 (0.47) MAPTNPC1RAB9AF2LMNA
SCHEMBL7629416 0.84 F2 (0.57) MAPTTDP1F2LMNA
SCHEMBL7635512 0.84 F2 (0.57) MAPTTDP1F2LMNA
SCHEMBL7634492 0.82 TDP1 (0.44) MAPTTDP1KMONPC1RAB9A
SCHEMBL7627887 0.80 KMT2A (0.50) MAPTNPC1RAB9AHDAC8

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