SCHEMBL9518796

SCHEMBL9518796

O=C(CC(=O)OC/C=C/c1ccccc1)OC/C=C/c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.54
MMP2 P08253 1/20 0.54
MMP9 P14780 1/20 0.54
MMP12 P39900 1/20 0.54
IDO1 P14902 2/20 0.53
PAM P19021 1/20 0.53
CACNA1B Q00975 7/20 0.51
MAOB P27338 1/20 0.49
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
RECQL P46063 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 1/20 0.45
NPC1 O15118 1/20 0.45
POLB P06746 1/20 0.45
HAO1 Q9UJM8 1/20 0.44
EGFR P00533 1/20 0.44

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
SCHEMBL9518811 0.93 PAM (0.55) MMP1MMP2MMP9MMP12IDO1
SCHEMBL9519601 0.91 PAM (0.53) MMP1MMP2MMP9MMP12IDO1
SCHEMBL9519585 0.91 PAM (0.53) MMP1MMP2MMP9MMP12IDO1
SCHEMBL5799249 0.90 MMP1 (0.49) MMP1MMP2MMP9MMP12IDO1
SCHEMBL28158105 0.90 MMP1 (0.49) MMP1MMP2MMP9MMP12IDO1
SCHEMBL5799253 0.90 MMP1 (0.49) MMP1MMP2MMP9MMP12IDO1
SCHEMBL27509127 0.89 MMP1 (0.54) MMP1MMP2MMP9MMP12IDO1
SCHEMBL9519594 0.89 MMP1 (0.48) MMP1MMP2MMP9MMP12IDO1
SCHEMBL28145343 0.88 MMP1 (0.50) MMP1MMP2MMP9MMP12IDO1
SCHEMBL8286254 0.88 CACNA1B (0.46) MMP1MMP2MMP9MMP12IDO1

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
WO-2024010706-A1 ENHANCED EUV MATERIALS, PHOTORESISTS AND METHODS OF THEIR USE ROBINSON ALEX P G (GB) 2024-01-11 WO disclosed
CN-1984976-B Aqueous vinyl polymer coating compositions DSM IP ASSETS BV 2011-05-18 CN disclosed
US-7326746-B2 Curable electron donor compositions NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION 2008-02-05 US disclosed
CN-1984976-A Aqueous vinyl polymer coating compositions DSM IP ASSETS BV (NL) 2007-06-20 CN disclosed
US-20070060683-A1 Curable electron donor compositions HENKEL AG & CO. KGAA (DE) 2007-03-15 US disclosed
EP-0300657-B1 4-SUBSTITUTED 3-OXOBUTANOATE ESTER DERIVATIVES MERCK & CO. INC. (US) 1993-03-31 EP disclosed
EP-0300657-A2 4-substituted 3-oxobutanoate ester derivatives MERCK & CO. INC. (US) 1989-01-25 EP disclosed