SCHEMBL15211713

SCHEMBL15211713

O=C(O)Cc1coc2c(Cl)c(OCc3ccc(Cl)cc3Cl)ccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.48
FABP4 P15090 1/20 0.48
FABP5 Q01469 1/20 0.48
NR4A2 P43354 2/20 0.47
MRGPRX4 Q96LA9 8/20 0.46
POLB P06746 3/20 0.46
DUSP3 P51452 1/20 0.46
PTPN5 P54829 1/20 0.46
PTPN11 Q06124 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
SAE1 Q9UBE0 1/20 0.46
UBA2 Q9UBT2 1/20 0.46
NR4A1 P22736 1/20 0.45
NR4A3 Q92570 1/20 0.45
PTGER1 P34995 2/20 0.44
CHRM1 P11229 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
HDAC8 Q9BY41 2/20 0.43
SLC26A4 O43511 1/20 0.43
MAPT P10636 1/20 0.42

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
SCHEMBL15211749 0.90 POLB (0.54) FABP3FABP4FABP5NR4A2MRGPRX4
SCHEMBL17444865 0.88 HDAC8 (0.47) FABP3FABP4FABP5NR4A2MRGPRX4
SCHEMBL15211842 0.88 FABP3 (0.46) FABP3FABP4FABP5NR4A2MRGPRX4
SCHEMBL15211631 0.87 MRGPRX4 (0.50) FABP3FABP4FABP5NR4A2MRGPRX4
SCHEMBL15211489 0.86 PPARD (0.55) FABP3FABP4FABP5NR4A2MRGPRX4
SCHEMBL15212882 0.86 POLB (0.44) FABP3FABP4FABP5NR4A2MRGPRX4
SCHEMBL15211372 0.81 HDAC8 (0.44) FABP3FABP4FABP5NR4A2MRGPRX4
SCHEMBL17431402 0.81 FABP3 (0.43) FABP3FABP4FABP5NR4A2MRGPRX4
SCHEMBL15211392 0.81 FABP4 (0.46) FABP3FABP4FABP5NR4A2MRGPRX4
SCHEMBL15211247 0.80 SMN1; SMN2 (0.46) FABP4FABP5POLBDUSP3PTPN5

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2838891-B1 AROMATIC RING COMPOUND AS GHRELIN O-ACYLTRANSFERASE INHIBITOR TAKEDA PHARMACEUTICALS CO (JP) 2017-08-02 EP disclosed
US-9238639-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-01-19 US disclosed
US-9238639-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-01-19 US disclosed
US-9238639-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-01-19 US disclosed
EP-2838891-A1 AROMATIC RING COMPOUND Takeda Pharmaceutical Company Limited (JP) 2015-02-25 EP disclosed
WO-2013125732-A1 AROMATIC RING COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-08-29 WO disclosed