SCHEMBL7986974

SCHEMBL7986974

CCOC(=O)C(C)(O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 2/20 0.51
CYP2C9 P11712 1/20 0.47
MMP8 P22894 1/20 0.46
POLB P06746 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
TARBP2 Q15633 1/20 0.43
ALDH1A1 P00352 2/20 0.42
RECQL P46063 1/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
RAB9A P51151 3/20 0.41
CYP1A2 P05177 1/20 0.41
NPC1 O15118 2/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL13574069 0.90 PIN1 (0.57) PIN1MMP8POLBNPSR1ALDH1A1
SCHEMBL5807773 0.90 PIN1 (0.57) PIN1MMP8POLBNPSR1ALDH1A1
SCHEMBL11846806 0.87 ESR1 (0.46) PIN1ALDH1A1MAPTCYP1A2LMNA
SCHEMBL11844527 0.86 MAPT (0.43) CYP2C9NPSR1ALDH1A1MAPTSMN1; SMN2
SCHEMBL11840274 0.86 LMNA (0.47) PIN1MMP8ALDH1A1MAPTSMN1; SMN2
SCHEMBL11845001 0.86 CYP1A2 (0.45) PIN1CYP2C9MMP8NPSR1TARBP2
SCHEMBL11837799 0.86 PIN1 (0.40) PIN1MMP8POLBNPSR1CYP1A2
SCHEMBL12032244 0.85 CNR2 (0.49) PIN1CYP2C9MMP8POLBNPSR1
SCHEMBL11839741 0.84 ALDH1A1 (0.49) POLBNPSR1TARBP2ALDH1A1RECQL
SCHEMBL7756224 0.84 NPC1 (0.52) PIN1CYP2C9MMP8POLBNPSR1

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 6 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
US-3941821-A ANTIINFLAMMATORY, ANALGESICS, ANTIPYRETICS WILLIAM H. RORER, INC. (US) 1976-03-02 US disclosed