SCHEMBL20769739

SCHEMBL20769739

COc1ccc2c(c1)c(CC(=O)O)cn2Cc1ccccc1

nearest known ligand 0.83

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 7/20 0.83
PPARG P37231 2/20 0.73
PPARD Q03181 2/20 0.73
PPARA Q07869 2/20 0.73
MTNR1A P48039 1/20 0.69
MTNR1B P49286 1/20 0.69
HTR6 P50406 1/20 0.66
LMNA P02545 4/20 0.64
ALDH1A1 P00352 3/20 0.64
PLA2G1B P04054 1/20 0.60
ICMT O60725 2/20 0.58
AKR1C4 P17516 1/20 0.57
PTGS1 P23219 1/20 0.57
AKR1C3 P42330 1/20 0.57
AKR1C2 P52895 1/20 0.57

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
SCHEMBL7696757 0.91 PLA2G2A (0.69) PLA2G2APPARGPPARDPPARAMTNR1A
SCHEMBL7963252 0.91 PLA2G2A (1.00) PLA2G2APPARGPPARDPPARAMTNR1A
SCHEMBL7962843 0.89 PLA2G2A (1.00) PLA2G2APPARGPPARDPPARAMTNR1A
SCHEMBL8171659 0.88 PPARD (0.82) PLA2G2APPARGPPARDPPARAMTNR1A
SCHEMBL3019384 0.88 MTNR1A (0.73) PLA2G2APPARGPPARDPPARAMTNR1A
SCHEMBL7962690 0.88 PLA2G2A (0.74) PLA2G2APPARGPPARDPPARAMTNR1A
SCHEMBL8290865 0.88 PLA2G2A (0.74) PLA2G2APPARGPPARDPPARAMTNR1A
SCHEMBL12083183 0.87 PLA2G2A (0.74) PLA2G2APPARGPPARDPPARAMTNR1A
SCHEMBL7692305 0.86 CHRM1 (0.65) PLA2G2APPARGPPARDPPARAMTNR1A
SCHEMBL2000965 0.85 PLA2G2A (0.63) PLA2G2APPARGPPARDPPARAMTNR1A

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-2019046668-A1 AMIDE SUBSTITUTED THIAZOLES AS PROTEIN SECRETION INHIBITORS KEZAR LIFE SCIENCES (US) 2019-03-07 WO disclosed