SCHEMBL7316722

SCHEMBL7316722

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
CA1 P00915 5/20 0.46
CA2 P00918 5/20 0.46
CA12 O43570 2/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46
CA14 Q9ULX7 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
TSHR P16473 1/20 0.43
MAPT P10636 3/20 0.42
NOTUM Q6P988 1/20 0.42
LOXL2 Q9Y4K0 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CASP3 P42574 1/20 0.39
RAB9A P51151 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL7302415 0.83 MAPT (0.47) ALDH1A1CA1CA2CA12CA7
SCHEMBL15278592 0.82 NR4A1 (0.39) CA1CA2CA12CA9CA14
SCHEMBL7346788 0.79 CA1 (0.59) ALDH1A1CA1CA2CA12CA7
SCHEMBL7302578 0.78 KMT2A (0.55) ALDH1A1TDP1MAPTMEN1KMT2A
SCHEMBL5694633 0.77 CA12 (0.42) ALDH1A1CA1CA2CA12CA7
SCHEMBL5694636 0.77 CA12 (0.42) ALDH1A1CA1CA2CA12CA7
SCHEMBL7312810 0.77 NR4A1 (0.56) ALDH1A1CA1CA2CA12CA9
SCHEMBL1613362 0.76 MAPT (0.56) ALDH1A1CA1CA2CA12CA7
SCHEMBL1613360 0.76 MAPT (0.56) ALDH1A1CA1CA2CA12CA7
4-Methylbenzoic Acid Methyl Ester SCHEMBL27220651 0.74 TDP1 (0.54) ALDH1A1CA1CA2CA12CA7

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