SCHEMBL8397201

SCHEMBL8397201

CCCc1oc(C)cc(=O)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.47
KDM4E B2RXH2 3/20 0.42
PTGS1 P23219 3/20 0.42
PTGS2 P35354 3/20 0.42
POLB P06746 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TP53 P04637 2/20 0.42
MAPT P10636 2/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
GAA P10253 1/20 0.42
ALOX15 P16050 1/20 0.42
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
MMP3 P08254 4/20 0.39
HSD17B3 P37058 1/20 0.39
BCL2 P10415 1/20 0.39

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
SCHEMBL9625177 0.89 MMP2 (0.45) MMP2KDM4EPTGS1PTGS2POLB
SCHEMBL8399916 0.88 MMP2 (0.44) MMP2KDM4EPTGS1PTGS2POLB
SCHEMBL9625193 0.85 MMP2 (0.47) MMP2KDM4EPTGS1PTGS2POLB
SCHEMBL5315829 0.85 MMP2 (0.49) MMP2KDM4EPTGS1PTGS2POLB
SCHEMBL9625259 0.82 MMP2 (0.45) MMP2KDM4EPTGS1PTGS2POLB
SCHEMBL2120661 0.81 MMP2 (0.49) MMP2KDM4EPTGS1PTGS2POLB
SCHEMBL9624732 0.81 MMP2 (0.44) MMP2KDM4EPTGS1PTGS2POLB
SCHEMBL3337458 0.79 KDM4E (0.65) KDM4EPOLBL3MBTL1MAPTCYP1A2
SCHEMBL13439135 0.76 MMP2 (0.46) MMP2KDM4EPTGS1PTGS2POLB
SCHEMBL10902995 0.76 BCL2 (0.55) MMP2KDM4EPTGS1PTGS2POLB

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5962480-A CONTAINING PYRAN-4-ONE OR PYRID-4-ONE RING WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 1999-10-05 US claimed
EP-0473764-A1 METAL COMPLEXES Hider, Robert Charles (GB) 1992-03-11 EP claimed
WO-1991014664-A1 METAL COMPLEXES HIDER ROBERT CHARLES (GB) 1991-10-03 WO claimed
US-5962480-A CONTAINING PYRAN-4-ONE OR PYRID-4-ONE RING WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 1999-10-05 US disclosed
EP-0838220-A1 DRUG FOR AMELIORATING BRAIN DISEASES WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 1998-04-29 EP disclosed
EP-0473764-A1 METAL COMPLEXES Hider, Robert Charles (GB) 1992-03-11 EP disclosed
WO-1991014664-A1 METAL COMPLEXES HIDER ROBERT CHARLES (GB) 1991-10-03 WO disclosed