SCHEMBL6204983

SCHEMBL6204983

N#Cc1c(Cl)cc(Cl)cc1COc1cccc(C(=O)C=C(O)C(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 6/20 0.50
NR4A1 P22736 1/20 0.50
NR4A3 Q92570 1/20 0.50
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
MRGPRX4 Q96LA9 5/20 0.43
HPD P32754 1/20 0.41
MAOB P27338 3/20 0.39
MAOA P21397 2/20 0.39
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
NR1H4 Q96RI1 1/20 0.37
GCK P35557 1/20 0.37
SMPD1 P17405 1/20 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
SCHEMBL6204976 1.00 NR4A2 (0.50) NR4A2NR4A1NR4A3NPC1RAB9A
SCHEMBL6204979 1.00 NR4A2 (0.50) NR4A2NR4A1NR4A3NPC1RAB9A
SCHEMBL6206140 0.89 NR4A2 (0.54) NR4A2NR4A1NR4A3NPC1RAB9A
SCHEMBL6206142 0.89 NR4A2 (0.54) NR4A2NR4A1NR4A3NPC1RAB9A
SCHEMBL6204484 0.89 NR4A2 (0.54) NR4A2NR4A1NR4A3NPC1RAB9A
SCHEMBL6205799 0.80 MRGPRX4 (0.48) NR4A2NR4A1NR4A3NPC1RAB9A
SCHEMBL6205485 0.80 MRGPRX4 (0.48) NR4A2NR4A1NR4A3NPC1RAB9A
SCHEMBL6205801 0.80 MRGPRX4 (0.48) NR4A2NR4A1NR4A3NPC1RAB9A
SCHEMBL6204198 0.80 MRGPRX4 (0.42) NR4A2NR4A1NR4A3NPC1RAB9A
SCHEMBL6204200 0.80 MRGPRX4 (0.42) NR4A2NR4A1NR4A3NPC1RAB9A

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-1100763-B1 DIKETOACID-DERIVATIVES AS INHIBITORS OF POLYMERASES ANGELETTI P IST RICHERCHE BIO (IT) 2005-06-22 EP claimed