SCHEMBL9075299

SCHEMBL9075299

O=C(O)c1cccc(C=Cc2cccc(C(=O)O)c2)c1.O=C(O)c1cccc(C=Cc2cccc(C(=O)O)c2)c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 5/20 0.79
UNG P13051 1/20 0.73
FBP1 P09467 1/20 0.68
P4HB P07237 3/20 0.64
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA6 P23280 1/20 0.56
CA9 Q16790 1/20 0.56
SRD5A1 P18405 1/20 0.53
SRD5A2 P31213 1/20 0.53
KMO O15229 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C9 P11712 1/20 0.52
HPGD P15428 1/20 0.52
HSD17B10 Q99714 1/20 0.52
DAO P14920 1/20 0.50
TSHR P16473 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
PLAU P00749 1/20 0.50

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
SCHEMBL808972 1.00 TTR (0.79) TTRUNGFBP1P4HBCA12
SCHEMBL808971 1.00 TTR (0.79) TTRUNGFBP1P4HBCA12
SCHEMBL8899992 1.00 TTR (0.79) TTRUNGFBP1P4HBCA12
SCHEMBL13926057 0.96 TTR (0.86) TTRUNGFBP1P4HBCA12
SCHEMBL1927539 0.96 TTR (0.79) TTRUNGFBP1P4HBCA12
SCHEMBL31317645 0.96 TTR (0.79) TTRUNGFBP1P4HBCA12
SCHEMBL1927537 0.96 TTR (0.79) TTRUNGFBP1P4HBCA12
SCHEMBL29759512 0.96 TTR (0.79) TTRUNGFBP1P4HBCA12
SCHEMBL5020598 0.96 TTR (0.79) TTRUNGFBP1P4HBCA12
SCHEMBL8901400 0.92 TTR (0.80) TTRUNGFBP1P4HBSRD5A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0519953-B1 ACYL PHOSPHATE ESTERS AND MODIFICATION OF PROTEINS THEREWITH UNIV TORONTO (CA) 1996-02-07 EP disclosed