SCHEMBL7984732

SCHEMBL7984732

CC1(c2ccc(-c3ccccc3)cc2)OC(=O)C(OCc2ccccc2)=C1O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.41
MMP13 P45452 1/20 0.41
GSTP1 P09211 2/20 0.39
CA9 Q16790 1/20 0.38
MCL1 Q07820 1/20 0.38
MAOB P27338 3/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
RIPK1 Q13546 1/20 0.38
ABCB1 P08183 1/20 0.38
MAPT P10636 1/20 0.38
FFAR1 O14842 1/20 0.37
FSHR P23945 1/20 0.37
PTPN1 P18031 1/20 0.36

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
SCHEMBL7988507 1.00 MMP2 (0.41) MMP2MMP13GSTP1CA9MCL1
SCHEMBL7991411 0.92 MMP2 (0.42) MMP2MMP13CA9MAOBRIPK1
SCHEMBL7983512 0.83 GSTP1 (0.40) MMP2MMP13GSTP1MCL1ABCB1
SCHEMBL7984522 0.80 MRGPRX4 (0.37) MMP2MMP13GSTP1MCL1MRGPRX4
SCHEMBL7987626 0.79 ACACB (0.35) MMP2MMP13GSTP1MCL1MRGPRX4
SCHEMBL6932927 0.77 CHRNA1 (0.42) MMP2MCL1MAPT
SCHEMBL7984718 0.77 CHRNA1 (0.42) MMP2MCL1MAPT
SCHEMBL7983353 0.77 CHRNA1 (0.42) MMP2MCL1MAPT
SCHEMBL7983389 0.75 LMNA (0.42) MMP2MMP13CA9MAOBMAPT
SCHEMBL7987829 0.70 MAOB (0.38) MMP2MMP13MAOBRIPK1MAPT

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 3 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