SCHEMBL8614795

SCHEMBL8614795

CN(c1ccc(C=CC(=O)c2ccc(OCc3ccccc3)cc2)cc1)c1ccc(C=CC(=O)c2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.76
ABCG2 Q9UNQ0 2/20 0.76
GSK3B P49841 1/20 0.61
BACE1 P56817 1/20 0.61
BCHE P06276 3/20 0.60
ACHE P22303 3/20 0.60
MAPT P10636 2/20 0.60
KMT2A Q03164 2/20 0.60
MAOA P21397 1/20 0.60
NPC1 O15118 1/20 0.60
RAB9A P51151 1/20 0.60
SLC5A1 P13866 1/20 0.59
SLC5A2 P31639 1/20 0.59
KDM4E B2RXH2 1/20 0.58
MEN1 O00255 1/20 0.58
TP53 P04637 1/20 0.58

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
SCHEMBL16242554 0.87 ABCG2 (0.87) MAOBABCG2GSK3BBACE1BCHE
SCHEMBL16242555 0.87 ABCG2 (0.87) MAOBABCG2GSK3BBACE1BCHE
SCHEMBL976816 0.86 MAOB (0.81) MAOBABCG2GSK3BBACE1MAPT
SCHEMBL976815 0.86 MAOB (0.81) MAOBABCG2GSK3BBACE1MAPT
SCHEMBL25199731 0.86 ABCG2 (1.00) MAOBABCG2GSK3BBACE1MAPT
SCHEMBL25223265 0.86 ABCG2 (1.00) MAOBABCG2GSK3BBACE1MAPT
SCHEMBL981324 0.84 ABCG2 (0.81) MAOBABCG2GSK3BBACE1MAPT
SCHEMBL25198204 0.84 ABCG2 (0.81) MAOBABCG2GSK3BBACE1MAPT
SCHEMBL981325 0.84 ABCG2 (0.81) MAOBABCG2GSK3BBACE1MAPT
SCHEMBL30383247 0.81 MAOB (0.73) MAOBABCG2GSK3BBACE1BCHE

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
EP-0561562-B1 Heat-sensitive or pressure-sensitive recording material WIGGINS TEAPE GROUP LTD (GB) 1998-05-06 EP disclosed
US-5364830-A Heat or pressure sensitive elements THE WIGGINS TEAPE GROUP LIMITED (GB) 1994-11-15 US disclosed
EP-0561562-A1 Heat-sensitive or pressure-sensitive recording material The Wiggins Teape Group Limited (GB) 1993-09-22 EP disclosed