SCHEMBL4600472

SCHEMBL4600472

Cc1c(O)cccc1OCc1ccc(Cl)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.55
FABP4 P15090 1/20 0.55
FABP5 Q01469 1/20 0.55
MRGPRX4 Q96LA9 2/20 0.51
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 3/20 0.49
GAA P10253 3/20 0.49
LMNA P02545 2/20 0.49
KDM4E B2RXH2 2/20 0.49
MEN1 O00255 2/20 0.49
MAPT P10636 2/20 0.49
THRB P10828 2/20 0.49
XBP1 P17861 2/20 0.49
BLM P54132 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
ALOX12 P18054 1/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
NR4A2 P43354 2/20 0.48
NR4A1 P22736 1/20 0.48

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
SCHEMBL9615329 0.85 FABP3 (0.57) FABP3FABP4FABP5MRGPRX4KMT2A
SCHEMBL12301132 0.79 PTGER1 (0.54) FABP3FABP4FABP5MRGPRX4ALDH1A1
SCHEMBL26746274 0.76 PDPK1 (0.43) MRGPRX4KMT2AALDH1A1MEN1MAPT
SCHEMBL2557709 0.75 ENPP2 (0.63) FABP3FABP4FABP5MRGPRX4KMT2A
SCHEMBL9414542 0.73 FABP4 (0.51) FABP3FABP4FABP5MRGPRX4KMT2A
SCHEMBL9824901 0.73 FABP3 (0.64) FABP3FABP4FABP5MRGPRX4KMT2A
SCHEMBL9825372 0.73 FABP3 (0.57) FABP3FABP4FABP5MRGPRX4KMT2A
SCHEMBL11711706 0.73 MRGPRX4 (0.65) MRGPRX4KMT2AALDH1A1LMNAMEN1
SCHEMBL11276165 0.73 NR4A2 (0.68) FABP3FABP4FABP5KMT2AALDH1A1
SCHEMBL5839484 0.71 FABP3 (0.78) FABP3FABP4FABP5MRGPRX4KMT2A

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-1912645-A2 THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2008-04-23 EP disclosed
WO-2007018314-A2 THERAPEUTIC AGENT FOR DIABETES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-15 WO disclosed