SCHEMBL6896602

SCHEMBL6896602

CCOC(=O)C(Cc1ccccc1)NS(=O)(=O)c1cccc(OC)c1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.59
POLB P06746 4/20 0.54
MMP2 P08253 5/20 0.53
MMP9 P14780 4/20 0.53
CTSL P07711 2/20 0.51
CTSS P25774 1/20 0.51
ITGAV P06756 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
THRB P10828 1/20 0.48
MEP1B Q16820 1/20 0.47
ADAMTS4 O75173 1/20 0.47

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
SCHEMBL7194146 0.93 MMP2 (0.53) BACE1POLBMMP2MMP9CTSL
SCHEMBL27396675 0.88 BACE1 (0.60) BACE1POLBMMP2MMP9CTSL
SCHEMBL6774068 0.86 BACE1 (0.67) BACE1POLBMMP2MMP9CTSL
SCHEMBL750395 0.82 BACE1 (0.58) BACE1POLBMMP2MMP9CTSL
SCHEMBL3837363 0.81 BACE1 (0.54) BACE1POLBMMP2MMP9CTSL
SCHEMBL3839373 0.80 BACE1 (0.53) BACE1POLBMMP2MMP9CTSL
SCHEMBL27568136 0.79 POLB (0.70) POLBMMP2MMP9CTSLCTSS
SCHEMBL6323453 0.79 MMP2 (0.73) POLBMMP2MMP9CTSLCTSS
SCHEMBL6323452 0.79 MMP2 (0.73) POLBMMP2MMP9CTSLCTSS
SCHEMBL29540673 0.79 MMP2 (0.73) POLBMMP2MMP9CTSLCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6833366-B1 Dihydrostilbene alkanoic acid derivatives PHARMACIA CORPORATION 2004-12-21 US disclosed
EP-1289959-A1 DIHYDROSTILBENE ALKANOIC ACID DERIVATIVES USEFUL AS VITRONECTIN ANTAGONISTS Pharmacia Corporation (US) 2003-03-12 EP disclosed
WO-2001096310-A1 DIHYDROSTILBENE ALKANOIC ACID DERIVATIVES USEFUL AS VITRONECTIN ANTAGONISTS PHARMACIA CORPORATION (US) 2001-12-20 WO disclosed