SCHEMBL524292

SCHEMBL524292

O=C([O-])COS(=O)(=O)[O-].[Cu+2]

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.32
GLA P06280 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
EPHX2 P34913 1/20 0.32
BLM P54132 1/20 0.32
CA4 P22748 2/20 0.32

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
SCHEMBL1902608 0.95 RECQL (0.32) RECQLGLAHPGDTSHRMAPK1
SCHEMBL5571006 0.95 RECQL (0.32) RECQLGLAHPGDTSHRMAPK1
Nitric Acid SCHEMBL3458284 0.84 CA5A (0.33)
Lithium Ion SCHEMBL28864518 0.74 TSHR (0.38) RECQLGLAHPGDTSHRMAPK1
SCHEMBL11798149 0.74 CA4 (0.36) TSHRCA4
SCHEMBL8611023 0.74 TSHR (0.38) RECQLGLAHPGDTSHRMAPK1
SCHEMBL11798630 0.72 ALDH1A1 (0.36) RECQLGLAHPGDTSHRMAPK1
SCHEMBL2197767 0.69 TP53 (0.36) RECQLGLAHPGDTSHRMAPK1
SCHEMBL1876123 0.69 TP53 (0.36) RECQLGLAHPGDTSHRMAPK1
SCHEMBL1876612 0.69 TP53 (0.36) RECQLGLAHPGDTSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2598208-A2 NEW USES Evocutis plc (GB) 2013-06-05 EP disclosed
WO-2012013967-A2 NEW USES SYNTOPIX GROUP PLC (GB) 2012-02-02 WO disclosed