SCHEMBL6661182

SCHEMBL6661182

CC12C(=O)OC(=O)C1C1C=CC2C1.CC1CCCC2=C1C(=O)OC2=O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL15726659 0.79 KDM4E (0.43) TDP1ALDH1A1GAAKDM4EPOLB
SCHEMBL10338131 0.79 KDM4E (0.43) TDP1ALDH1A1GAAKDM4EPOLB
SCHEMBL31490487 0.79 KDM4E (0.43) TDP1ALDH1A1GAAKDM4EPOLB
SCHEMBL3112271 0.79 KDM4E (0.43) TDP1ALDH1A1GAAKDM4EPOLB
SCHEMBL195658 0.79 KDM4E (0.43) TDP1ALDH1A1GAAKDM4EPOLB
Phthalic Anhydride SCHEMBL18393931 0.74 TDP1 (0.41) TDP1ALDH1A1GAAKDM4EPOLB
SCHEMBL253698 0.74 CA1 (0.43)
SCHEMBL6661184 0.72
SCHEMBL20171638 0.69 TP53 (0.32) TDP1KDM4E
SCHEMBL12359375 0.69 TP53 (0.32) TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1299447-B1 NO-FLOW FLUX ADHESIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES CO (US) 2004-08-25 EP disclosed
EP-1299447-A2 NO-FLOW FLUX ADHESIVE COMPOSITIONS 3M Innovative Properties Company (US) 2003-04-09 EP disclosed
US-6528169-B2 One-part, thermally-curable adhesive composition comprising: an epoxy resin substantially free of hydroxyl functionality; and an anhydride curing agent. 3M INNOVATIVE PROPERTIES COMPANY 2003-03-04 US disclosed
US-20020032280-A1 No-flow flux adhesive compositions 3M INNOVATIVE PROPERTIES COMPANY 2002-03-14 US disclosed
WO-2002004541-A2 NO-FLOW FLUX ADHESIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2002-01-17 WO disclosed