SCHEMBL6607754

SCHEMBL6607754

Cc1ccccc1OB(Oc1ccccc1C)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SCN4A P35499 2/20 0.38
ACHE P22303 1/20 0.38
ALDH1A1 P00352 2/20 0.36
GLA P06280 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
ORAI1 Q96D31 1/20 0.36
ORAI2 Q96SN7 1/20 0.36
ORAI3 Q9BRQ5 1/20 0.36
TRPV6 Q9H1D0 1/20 0.36
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL969625 0.79 ENPP2 (0.39) TSHRKMT2AMEN1NPC1RAB9A
SCHEMBL29435906 0.77 TSHR (0.46) TSHRKMT2AMEN1NPC1RAB9A
SCHEMBL717122 0.77 TSHR (0.46) TSHRKMT2AMEN1NPC1RAB9A
SCHEMBL30366069 0.75 TSHR (0.45) TSHRKMT2AMEN1NPC1RAB9A
SCHEMBL350128 0.75 TSHR (0.45) TSHRKMT2AMEN1NPC1RAB9A
SCHEMBL22056735 0.75 TSHR (0.45) TSHRKMT2AMEN1NPC1RAB9A
Hydrogen Peroxide SCHEMBL28159758 0.74 TSHR (0.48) TSHRKMT2AMEN1NPC1RAB9A
SCHEMBL22878 0.73 TSHR (0.53) TSHRKMT2AMEN1NPC1RAB9A
SCHEMBL29349760 0.73 TSHR (0.53) TSHRKMT2AMEN1NPC1RAB9A
SCHEMBL30197899 0.73 CA1 (0.44) TSHRKMT2AMEN1NPC1RAB9A

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-1423386-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-02 EP disclosed
WO-2003022842-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-20 WO disclosed