SCHEMBL8375480

SCHEMBL8375480

C/C=C/c1ccc(Oc2ccc(C(=O)O)cc2S(C)(=O)=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.45
HTT P42858 1/20 0.45
TTR P02766 2/20 0.43
PKM P14618 1/20 0.43
ABL1 P00519 1/20 0.40
EGFR P00533 1/20 0.40
ABL2 P42684 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
XDH P47989 1/20 0.39
KDM4E B2RXH2 1/20 0.38
POLB P06746 2/20 0.38
APEX1 P27695 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CASP1 P29466 1/20 0.37
TNFRSF1A P19438 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
CA12 O43570 1/20 0.37

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
SCHEMBL8375481 1.00 HPGD (0.45) HPGDHTTTTRPKMABL1
SCHEMBL8379051 0.88 VCAM1 (0.43) HPGDHTTEGFRALDH1A1NPSR1
SCHEMBL8379048 0.88 VCAM1 (0.43) HPGDHTTEGFRALDH1A1NPSR1
SCHEMBL8073502 0.87 TTR (0.51) TTRPKMALDH1A1NPSR1POLB
SCHEMBL7995261 0.83 TTR (0.61) TTRPKMALDH1A1NPSR1POLB
SCHEMBL8070954 0.82 PKM (0.50) TTRPKMALDH1A1TSHRNPSR1
SCHEMBL8059364 0.80 PKM (0.55) HTTTTRPKMALDH1A1POLB
SCHEMBL8059681 0.80 TTR (0.45) TTRPKMNPSR1POLBAPEX1
SCHEMBL8068490 0.79 TTR (0.44) TTRPKMALDH1A1NPSR1POLB
SCHEMBL8070909 0.78 SRD5A2 (0.56) TTRALDH1A1KDM4EPOLB

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
US-5880156-A ANTIARRHYTHMIA AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1999-03-09 US disclosed