SCHEMBL9504411

SCHEMBL9504411

C/C=C\c1ccccc1Oc1ccc(C(=O)c2ccccc2Oc2ccccc2/C=C\C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.49
HTT P42858 2/20 0.48
STS P08842 1/20 0.44
MAOB P27338 1/20 0.43
LMNA P02545 4/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CTNNB1 P35222 1/20 0.41
KMT2A Q03164 2/20 0.40
PARP10 Q53GL7 1/20 0.40
BCL2 P10415 1/20 0.40
MCL1 Q07820 1/20 0.40
TLR4 O00206 1/20 0.40
TLR2 O60603 1/20 0.40
ELANE P08246 1/20 0.40
HPGD P15428 1/20 0.40
SRD5A2 P31213 2/20 0.39

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
SCHEMBL9504416 1.00 GAA (0.49) GAAHTTSTSMAOBLMNA
SCHEMBL8712513 0.90 ELANE (0.49) GAAHTTMAOBLMNASMN1; SMN2
SCHEMBL10431024 0.90 ELANE (0.49) GAAHTTMAOBLMNASMN1; SMN2
SCHEMBL158895 0.90 GAA (0.55) GAAHTTMAOBLMNAALDH1A1
SCHEMBL158896 0.90 GAA (0.55) GAAHTTMAOBLMNAALDH1A1
SCHEMBL29399051 0.90 GAA (0.55) GAAHTTMAOBLMNAALDH1A1
SCHEMBL25498288 0.90 GAA (0.55) GAAHTTMAOBLMNAALDH1A1
SCHEMBL12227188 0.90 GAA (0.55) GAAHTTMAOBLMNAALDH1A1
SCHEMBL29533606 0.90 GAA (0.55) GAAHTTMAOBLMNAALDH1A1
SCHEMBL9504448 0.87 GAA (0.56) GAAHTTMAOBLMNAALDH1A1

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-0230741-B1 CURABLE RESINS Technochemie GmbH - Verfahrenstechnik (DE) 1993-08-11 EP disclosed
US-4939305-A High fracture toughness TECHNOCHEMIE GMBH (DE) 1990-07-03 US disclosed
US-4917954-A Laminated article from curable resin composition comprising bis maleimide and alkenyl phenyl hydroxy ether TECHNOCHEMIE GMBH (DE) 1990-04-17 US disclosed
US-4871821-A TOUGHNESS TECHNOCHEMIE GMBH (DE) 1989-10-03 US disclosed
US-4789704-A BINDERS FOR COMPOSITES, FILMS, LAMINATES; HIGH FRACTURE TOUGHNESS TECHNOCHEMIE GMBH (DE) 1988-12-06 US disclosed