SCHEMBL7973235

SCHEMBL7973235

CCC/C=C\Cc1ccccc1/C=C\CCC1OC(=O)C(O)=C1O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 8/20 0.38
PTGER3 P43115 8/20 0.38
PTGER2 P43116 8/20 0.38
PTGER1 P34995 6/20 0.38
CES2 O00748 1/20 0.31
CDC25A P30304 1/20 0.31
CDC25B P30305 1/20 0.31
DUSP3 P51452 1/20 0.31
KDM4E B2RXH2 1/20 0.30
TLR8 Q9NR97 1/20 0.30
MAOB P27338 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
SCHEMBL7972867 0.80 KDM4E (0.35) PTGER4PTGER3PTGER2PTGER1KDM4E
SCHEMBL8179854 0.80 KDM4E (0.35) PTGER4PTGER3PTGER2PTGER1KDM4E
SCHEMBL7973126 0.74 KDM4E (0.40) KDM4EMAOB
SCHEMBL7973239 0.72 TOP1 (0.32) CES2CDC25ACDC25BDUSP3
SCHEMBL8775359 0.72 TRPV1 (0.45) DUSP3KDM4E
SCHEMBL8775295 0.72 TRPV1 (0.45) DUSP3KDM4E
SCHEMBL6933381 0.72 TRPV1 (0.45) DUSP3KDM4E
SCHEMBL6933386 0.72 TRPV1 (0.45) DUSP3KDM4E
SCHEMBL8775261 0.72 ABHD16A (0.45) CES2CDC25ACDC25BDUSP3
SCHEMBL8775675 0.72 ABHD16A (0.45) CES2CDC25ACDC25BDUSP3

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
US-6262073-B1 INHIBITING THE ACTION OF A PRO-INFLAMMATORY CYTOKINE OXIS INTERNATIONAL INC. 2001-07-17 US disclosed
US-6136832-A RACEMIC MIXTURES AND ENANTIOMORPHS OXIS INTERNATIONAL INC. (US) 2000-10-24 US disclosed
US-6005000-A 5,5-Disubstituted-3, 4-dihydroxy-2(5H)-furanones and methods of use therefor OXIS INTERNATIONAL, INC. (US) 1999-12-21 US disclosed
EP-0938482-A1 5-SUBSTITUTED AND 5,5-DISUBSTITUTED-3,4-DIHYDROXY-2(5H)-FURANONES AND METHODS OF USE THEREFOR Oxis International, Inc. (US) 1999-09-01 EP disclosed
WO-1998007714-A1 5-SUBSTITUTED AND 5,5-DISUBSTITUTED-3,4-DIHYDROXY-2(5H)-FURANONES AND METHODS OF USE THEREFOR OXIS INTERNATIONAL, INC. (US) 1998-02-26 WO disclosed