SCHEMBL6941812

SCHEMBL6941812

O=C1CC=CC=C1c1ccc(O)c(O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.43
ALOX5 P09917 7/20 0.38
QDPR P09417 3/20 0.37
SNCA P37840 3/20 0.36
PTGS2 P35354 1/20 0.36
KDM4E B2RXH2 3/20 0.36
CYP3A4 P08684 3/20 0.36
MAPT P10636 3/20 0.36
ALOX15 P16050 3/20 0.36
MAPK1 P28482 3/20 0.36
HSD17B10 Q99714 3/20 0.36
IP6K2 Q9UHH9 2/20 0.36
POLH Q9Y253 2/20 0.36
MEN1 O00255 2/20 0.36
CYP2C9 P11712 2/20 0.36
ALOX12 P18054 2/20 0.36
CYP2C19 P33261 2/20 0.36
RECQL P46063 2/20 0.36
KMT2A Q03164 2/20 0.36
ST6GAL1 P15907 2/20 0.36

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
SCHEMBL9764763 0.80 ESR1 (0.37)
SCHEMBL13519167 0.74 CA1 (0.45) KDM4ECYP3A4MAPTMEN1CYP2C9
SCHEMBL6272816 0.73 HSD17B3 (0.40) APPPTGS2KDM4EMAPTMAPK1
SCHEMBL5848037 0.72
SCHEMBL668518 0.72 BACE1 (0.39) MAPTALDH1A1SMN1; SMN2
SCHEMBL10589880 0.69 KIF11 (0.38) PTGS2HSD17B10TNKSALDH1A1
SCHEMBL338028 0.65 APP (1.00) APPALOX5QDPRSNCACYP3A4
SCHEMBL345406 0.64
SCHEMBL6643593 0.63
SCHEMBL4750813 0.61

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-6759367-B2 COMPRISING THERMOSENSITIVE ELEMENT AND SUPPORT, THE THERMOSENSITIVE ELEMENT CONTAINING A SUBSTANTIALLY LIGHT-INSENSITIVE ORGANIC SILVER SALT, A 3,4-DIHYDROXYBENZENE COMPOUND, A BINDER AGFA-GEVAERT (BE) 2004-07-06 US disclosed
US-20030054958-A1 Thermographic recording material with improved print archivability without loss in printability AGFA-GEVAERT (BE) 2003-03-20 US disclosed
EP-1245404-A1 Thermographic recording material providing prints with good image density and tone having improved archivability Agfa-Gevaert (BE) 2002-10-02 EP disclosed