SCHEMBL7302575

SCHEMBL7302575

CC(=Cc1ccc(C(=O)OCc2ccccc2)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.52
TDP1 Q9NUW8 3/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A3 Q01959 1/20 0.52
LMNA P02545 3/20 0.52
MAPT P10636 7/20 0.50
ALDH1A1 P00352 4/20 0.50
HPGD P15428 2/20 0.50
RAB9A P51151 3/20 0.46
GAA P10253 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 4/20 0.42
NR1H4 Q96RI1 1/20 0.42
NPC1 O15118 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSP90AA1 P07900 2/20 0.41
SYK P43405 1/20 0.41
KDM4E B2RXH2 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ADRB2 P07550 1/20 0.40

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
SCHEMBL7302569 1.00 KMT2A (0.52) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL7305597 0.84 KMT2A (0.61) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL7305593 0.84 KMT2A (0.61) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL5606740 0.82 NR1H4 (0.58) KMT2AMAPTALDH1A1HPGDRAB9A
SCHEMBL24848155 0.81 KMT2A (0.69) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL19399055 0.81 KMT2A (0.49) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL20853874 0.80 AKR1C3 (0.58) KMT2ATDP1ALDH1A1HPGDRAB9A
SCHEMBL28915528 0.80 AKR1C3 (0.58) KMT2ATDP1ALDH1A1HPGDRAB9A
SCHEMBL7316708 0.79 ALDH1A1 (0.51) TDP1LMNAMAPTALDH1A1RAB9A
SCHEMBL7316713 0.79 ALDH1A1 (0.51) TDP1LMNAMAPTALDH1A1RAB9A

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