SCHEMBL18701547

SCHEMBL18701547

O=C(O)c1c(Cl)sc(Cl)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.42
DAO P14920 4/20 0.38
DPP4 P27487 1/20 0.34
MCL1 Q07820 3/20 0.32
GPR35 Q9HC97 1/20 0.32
ALDH1A1 P00352 3/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
CYP1A2 P05177 1/20 0.31
MAPK1 P28482 2/20 0.31
BCKDK O14874 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
HTT P42858 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HSD17B10 Q99714 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL6058482 0.86 DAO (0.42) GSK3BDAODPP4MCL1GPR35
SCHEMBL18701608 0.80 MCL1 (0.42) GSK3BDAODPP4MCL1GPR35
SCHEMBL25307067 0.80 GSK3B (0.39) GSK3BDAOMCL1
SCHEMBL18701752 0.78 DAO (0.34) GSK3BDAODPP4BCKDK
SCHEMBL18701632 0.78 GSK3B (0.38) GSK3BDAODPP4BCKDK
SCHEMBL19733065 0.76 DAO (0.39) GSK3BDAODPP4GPR35ALDH1A1
SCHEMBL18701671 0.75 DAO (0.35) DAODPP4BCKDK
SCHEMBL8629628 0.75 DAO (0.42) DAODPP4GPR35ALDH1A1HPGD
SCHEMBL18701546 0.73 DAO (0.34) GSK3BDAODPP4BCKDK
SCHEMBL18701691 0.72 MCL1 (0.44) DAODPP4MCL1GPR35ALDH1A1

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
US-20180282605-A1 METHOD OF MONITORING A PARAMETER OF A HYDROCARBON WELL, PIPELINE OR FORMATION JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2018-10-04 US disclosed
WO-2017060699-A1 METHOD OF MONITORING A PARAMETER OF A HYDROCARBON WELL, PIPELINE OR FORMATION JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2017-04-13 WO disclosed