SCHEMBL7973126

SCHEMBL7973126

O=C1OC(CC/C=C\c2ccccc2)C(O)=C1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
PAM P19021 1/20 0.40
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
NAAA Q02083 2/20 0.36
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
SIGMAR1 Q99720 2/20 0.35
MAOB P27338 1/20 0.35
GSTP1 P09211 1/20 0.35
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34

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 0.81 KDM4E (0.35) KDM4EALDH1A1MAPTPOLB
SCHEMBL8775359 0.71 TRPV1 (0.45) KDM4EALDH1A1MAPTHPGD
SCHEMBL8775295 0.71 TRPV1 (0.45) KDM4EALDH1A1MAPTHPGD
SCHEMBL8775255 0.71 ABHD16A (0.45) ALDH1A1MAPTPOLB
SCHEMBL8775675 0.71 ABHD16A (0.45) ALDH1A1MAPTPOLB
SCHEMBL7973128 0.69 MAOB (0.46) KDM4EALDH1A1MAPTPOLBMAOB
SCHEMBL11703434 0.68 SIGMAR1 (0.44) KDM4EPAMALDH1A1NAAASIGMAR1
SCHEMBL3240089 0.67 IDO1 (0.52) PAMSIGMAR1MAOBHDAC3HDAC4
Cinnamaldehyde SCHEMBL16626204 0.67 LMNA (0.47) KDM4EALDH1A1MAPTPOLBHPGD
SCHEMBL7939387 0.67 IDO1 (0.56) PAMALDH1A1SIGMAR1MAOBIDO1

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