SCHEMBL7986964

SCHEMBL7986964

Cc1ccccc1C#CCCC1OC(=O)C(O)=C1O

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
FFAR1 O14842 7/20 0.33
FFAR4 Q5NUL3 2/20 0.33
CHRM2 P08172 1/20 0.33
S1PR1 P21453 1/20 0.33
FPR1 P21462 1/20 0.33
FPR3 P25089 1/20 0.33
GPR183 P32249 1/20 0.33
APLNR P35414 1/20 0.33
GPR65 Q8IYL9 1/20 0.33
CDC25A P30304 1/20 0.30
CDC25B P30305 1/20 0.30
DUSP3 P51452 1/20 0.30
TSHR P16473 1/20 0.30
CHRNA7 P36544 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
SCHEMBL7972906 0.81 KDM4E (0.40) KDM4EFFAR1FFAR4
SCHEMBL7990674 0.78 KDM4E (0.34) KDM4E
SCHEMBL7985408 0.77 KDM4E (0.34) KDM4E
SCHEMBL7983529 0.77 KDM4E (0.34) KDM4E
SCHEMBL7983478 0.76 KDM4E (0.37) KDM4ECDC25ACDC25BDUSP3
SCHEMBL7990754 0.71 PTPN1 (0.40) KDM4ECDC25BDUSP3
SCHEMBL7983531 0.69 FFAR1 (0.32) FFAR1FFAR4
SCHEMBL7972867 0.68 KDM4E (0.35) KDM4ETSHR
SCHEMBL6927981 0.66 MAPT (0.44) KDM4ECDC25BDUSP3
SCHEMBL27350792 0.66 TSHR (0.48) FFAR1FFAR4CHRM2S1PR1FPR1

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