SCHEMBL7973591

SCHEMBL7973591

COc1ccc(C(C(=O)O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.58
CNR2 P34972 1/20 0.54
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
FNTA P49354 1/20 0.48
FNTB P49356 1/20 0.48
LDHA P00338 1/20 0.47
UTS2R Q9UKP6 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
GAA P10253 1/20 0.47
PTGS2 P35354 5/20 0.46
MAOB P27338 2/20 0.46
MAOA P21397 1/20 0.46
PTGS1 P23219 2/20 0.46
AKR1C3 P42330 2/20 0.46
AKR1C2 P52895 2/20 0.46
CDC42 P60953 1/20 0.46

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
SCHEMBL7044804 0.91 LDHA (0.55) CNR2LDHAMAPTPTGS2PTGS1
SCHEMBL2302103 0.86 HPGD (0.58) HPGDCNR2KMT2AMEN1FNTA
SCHEMBL11431074 0.86 HPGD (0.58) HPGDCNR2KMT2AMEN1FNTA
SCHEMBL1716394 0.85 ACP3 (0.61) CNR2KMT2AMEN1LDHAPOLB
SCHEMBL467546 0.84 HDAC4 (0.59) CNR2KMT2AMEN1LMNAPOLB
SCHEMBL31560153 0.84 LTA4H (0.53) CNR2KMT2AMEN1LDHAMAPT
Hydrochloric Acid SCHEMBL933980 0.82 HDAC4 (0.57) CNR2KMT2AMEN1LMNAPOLB
SCHEMBL934527 0.81 PPARG (0.55) HPGDCNR2KMT2AMEN1FNTA
SCHEMBL16807279 0.81 HPGD (0.57) HPGDCNR2KMT2AMEN1TDP1
Acetic Acid SCHEMBL9138173 0.81 HPGD (0.70) HPGDCNR2KMT2AMEN1LMNA

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-2001002364-A1 NEW NPY ANTAGONISTS ASTRAZENECA AB (SE) 2001-01-11 WO disclosed