SCHEMBL20769656

SCHEMBL20769656

CC(c1ccccc1Cl)n1cc(CC(=O)O)c2cc(Cl)ccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 3/20 0.46
LTB4R Q15722 1/20 0.46
METTL3 Q86U44 1/20 0.45
METTL14 Q9HCE5 1/20 0.45
AKR1C3 P42330 2/20 0.44
AKR1C2 P52895 2/20 0.44
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
AKR1C4 P17516 1/20 0.42
PTGS1 P23219 1/20 0.42
KMT2A Q03164 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39
CXCL8 P10145 1/20 0.39
CYP2C9 P11712 1/20 0.39
CHRM1 P11229 1/20 0.39
CCR2 P41597 1/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
SLC22A12 Q96S37 1/20 0.38
PPARG P37231 1/20 0.38

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
SCHEMBL20769687 1.00 PLA2G4A (0.46) PLA2G4ALTB4RMETTL3METTL14AKR1C3
SCHEMBL20791848 0.88 PLA2G4A (0.46) PLA2G4ALTB4RMETTL3METTL14AKR1C3
SCHEMBL20769708 0.87 PLA2G4A (0.53) PLA2G4ALTB4RMETTL3METTL14AKR1C3
SCHEMBL20769732 0.83 AKR1C3 (0.48) PLA2G4ALTB4RMETTL3METTL14AKR1C3
SCHEMBL20769727 0.80 AKR1C3 (0.48) PLA2G4ALTB4RMETTL3METTL14AKR1C3
SCHEMBL20787962 0.78 MET (0.39) PLA2G4ALTB4RMETTL3METTL14LMNA
SCHEMBL20788555 0.75 ALDH1A1 (0.46) PLA2G4AAKR1C3AKR1C2ALDH1A1LMNA
SCHEMBL20769651 0.74 ALDH1A1 (0.60) PLA2G4AALDH1A1LMNACXCL8CYP2C9
SCHEMBL6242130 0.73 KMT2A (0.52) AKR1C3AKR1C2ALDH1A1LMNAAKR1C4
SCHEMBL20769701 0.73 ICMT (0.57) AKR1C3AKR1C2ALDH1A1LMNAAKR1C4

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