SCHEMBL7985691

SCHEMBL7985691

C=CC(O)C1OC(=O)C(OCc2ccccc2)=C1OCc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPSE Q9Y251 1/20 0.38
MAPK14 Q16539 1/20 0.36
ALPG P10696 1/20 0.35
PTK2B Q14289 1/20 0.35
SIRT1 Q96EB6 3/20 0.34
NSD2 O96028 1/20 0.34
ABL1 P00519 1/20 0.34
PPARG P37231 1/20 0.34
RIN1 Q13671 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NCOR2 Q9Y618 1/20 0.34
BCHE P06276 2/20 0.34
LMNA P02545 2/20 0.33
TSHR P16473 2/20 0.33
NR4A1 P22736 1/20 0.33
NR4A2 P43354 1/20 0.33
NR4A3 Q92570 1/20 0.33
CYP1A2 P05177 1/20 0.33
PTGS1 P23219 1/20 0.33
SLC6A2 P23975 1/20 0.33

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
SCHEMBL2793853 0.81 HPSE (0.45) HPSEALPGPTK2BNSD2ABL1
SCHEMBL6257581 0.81 HPSE (0.45) HPSEALPGPTK2BNSD2ABL1
SCHEMBL2793857 0.81 HPSE (0.45) HPSEALPGPTK2BNSD2ABL1
SCHEMBL25383684 0.81 HPSE (0.45) HPSEALPGPTK2BNSD2ABL1
SCHEMBL13013400 0.81 HPSE (0.45) HPSEALPGPTK2BNSD2ABL1
SCHEMBL25383688 0.81 HPSE (0.45) HPSEALPGPTK2BNSD2ABL1
SCHEMBL6016817 0.80 HPSE (0.39) HPSEALPGPTK2BNSD2ABL1
SCHEMBL14692609 0.74 HPSE (0.39) HPSEALPGPTK2BNSD2ABL1
SCHEMBL14692612 0.74 HPSE (0.39) HPSEALPGPTK2BNSD2ABL1
SCHEMBL14704565 0.74 HPSE (0.39) HPSEALPGPTK2BNSD2ABL1

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