SCHEMBL7302578

SCHEMBL7302578

CC(=CC(=O)OC(C)(C)C)c1ccc(C(=O)OCc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.55
TDP1 Q9NUW8 4/20 0.55
SLC6A2 P23975 1/20 0.55
SLC6A3 Q01959 1/20 0.55
LMNA P02545 3/20 0.55
MAPT P10636 5/20 0.52
ALDH1A1 P00352 5/20 0.52
HPGD P15428 2/20 0.52
RAB9A P51151 3/20 0.48
GAA P10253 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.46
LTB4R Q15722 1/20 0.44
LTB4R2 Q9NPC1 1/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SYK P43405 1/20 0.43
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
ADRB2 P07550 1/20 0.41

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
SCHEMBL7312386 0.84 KMT2A (0.65) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL7305605 0.84 KMT2A (0.65) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL24848155 0.83 KMT2A (0.69) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL21874303 0.80 KMT2A (0.59) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL15866901 0.79 ALDH1A1 (0.50) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL7316722 0.78 ALDH1A1 (0.46) KMT2ATDP1MAPTALDH1A1RAB9A
SCHEMBL7302575 0.78 KMT2A (0.52) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL7302569 0.78 KMT2A (0.52) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL7302415 0.77 MAPT (0.47) KMT2ATDP1MAPTALDH1A1L3MBTL1
SCHEMBL312287 0.77 KMT2A (0.92) KMT2ATDP1SLC6A2SLC6A3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0656349-B1 Amidinophenol derivatives having phospholipase A2 inhibitory activity ONO PHARMACEUTICAL CO (JP) 1998-04-08 EP disclosed
US-5622984-A INHIBITORS OF PHOSPHOLIPASE, VARIOUS PROTEASES ONO PHARMACEUTICAL COMPANY, LIMITED (JP) 1997-04-22 US disclosed
US-5614555-A Amidinophenol derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1997-03-25 US disclosed
EP-0588655-B1 Amidinophenol derivatives ONO PHARMACEUTICAL CO (JP) 1996-12-04 EP disclosed
US-5514713-A Amidinophenol derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1996-05-07 US disclosed
US-5432178-A Substituted benzoic acid esters; use to prevent or treat inflammatory diseases, allergic diseases, disseminated intravascular coagulation, pancreatitis or multiple organ failure ONO PHARMACEUTICAL CO., LTD. (JP) 1995-07-11 US disclosed
EP-0656349-A1 Amidinophenol derivatives having phospholipase A2 inhibitory activity ONO PHARMACEUTICAL CO., LTD. (JP) 1995-06-07 EP disclosed
EP-0588655-A1 Amidinophenol derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1994-03-23 EP disclosed