SCHEMBL7990754

SCHEMBL7990754

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.40
MAPT P10636 4/20 0.40
RECQL P46063 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
ACP1 P24666 3/20 0.40
CDC25B P30305 3/20 0.40
PTPN2 P17706 1/20 0.40
DUSP3 P51452 1/20 0.40
HPSE Q9Y251 1/20 0.40
CES2 O00748 1/20 0.39
BLM P54132 2/20 0.38
HSPD1 P10809 1/20 0.38
HSPE1 P61604 1/20 0.38
TST Q16762 1/20 0.38
PTPN7 P35236 4/20 0.37
HMGCR P04035 1/20 0.37
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL8116635 0.84 CES2 (0.51) PTPN1MAPTRECQLTDP1ACP1
SCHEMBL8775172 0.82 CES2 (0.54) PTPN1MAPTRECQLTDP1ACP1
SCHEMBL6934073 0.82 CES2 (0.54) PTPN1MAPTRECQLTDP1ACP1
SCHEMBL8775161 0.82 CES2 (0.54) PTPN1MAPTRECQLTDP1ACP1
SCHEMBL8775076 0.82 CES2 (0.54) PTPN1MAPTRECQLTDP1ACP1
SCHEMBL8775369 0.82 CES2 (0.54) PTPN1MAPTRECQLTDP1ACP1
SCHEMBL6927981 0.78 MAPT (0.44) PTPN1MAPTRECQLTDP1ACP1
SCHEMBL7988278 0.76 PTPN1 (0.40) PTPN1MAPTRECQLTDP1ACP1
SCHEMBL7985694 0.76 MAPT (0.40) PTPN1MAPTRECQLTDP1ACP1
SCHEMBL8775261 0.75 ABHD16A (0.45) PTPN1MAPTRECQLTDP1ACP1

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