SCHEMBL7070085

SCHEMBL7070085

CCOc1ccc(CNc2cc(OCCC(CC)C(=O)O)ccc2NC(C)=O)c(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.36
EPHX1 P07099 1/20 0.36
LMNA P02545 4/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
EPHX2 P34913 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
FFAR1 O14842 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
TSHR P16473 1/20 0.34
RORC P51449 1/20 0.34
KDM4E B2RXH2 3/20 0.34
P4HB P07237 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 4/20 0.34
SMN1; SMN2 Q16637 2/20 0.34

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
SCHEMBL7064560 0.93 HRH3 (0.39) LMNAPPARDPPARATSHRKDM4E
SCHEMBL7070089 0.83 FFAR1 (0.36) MAPTEPHX1LMNAKMT2AMEN1
SCHEMBL7065211 0.81 IDO1 (0.39) MAPTKMT2AMEN1PPARDPPARA
SCHEMBL6497406 0.81 BRD4 (0.41) MAPTEPHX1LMNAKMT2AMEN1
SCHEMBL7068046 0.79 HDAC1 (0.39) LMNAKMT2AMEN1EPHX2PPARD
SCHEMBL7068552 0.78 KMT2A (0.43) LMNAKMT2AMEN1CYP1A2NPSR1
SCHEMBL6496310 0.78 THRB (0.41) KMT2AMEN1KDM4EP4HBNPSR1
SCHEMBL6301182 0.78 KMT2A (0.47) MAPTLMNAKMT2AMEN1CYP1A2
SCHEMBL7132256 0.76 KDM4E (0.35) KDM4EP4HBNPSR1
SCHEMBL7132250 0.75 KDM4E (0.35) PPARAKDM4EP4HBNPSR1ALDH1A1

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
WO-2004108686-A2 BENZIMIDAZOLE COMPOUNDS HAVING HYPOGLYCEMIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-16 WO disclosed