SCHEMBL27473003

SCHEMBL27473003

CCOC(=O)CCCCc1cc2c(Cl)cc(OCc3ccccc3)cc2n1C(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.43
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
LTA4H P09960 2/20 0.39
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
ALOX5 P09917 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
TBXAS1 P24557 1/20 0.37
LMNA P02545 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PTPN1 P18031 1/20 0.37
FFAR1 O14842 1/20 0.36
MAPT P10636 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MCL1 Q07820 1/20 0.36

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
SCHEMBL7947037 0.79 PLA2G2A (0.49) PLA2G2ALMNAL3MBTL1MAPTALDH1A1
SCHEMBL7955788 0.74 LMNA (0.44) PPARGNR1H4LMNAL3MBTL1MAPT
SCHEMBL7947040 0.73 CNR1 (0.46) PLA2G2ANR1H4L3MBTL1ALDH1A1
SCHEMBL8890454 0.73 FFAR1 (0.59) LTA4HALOX5NR1H4LMNAL3MBTL1
SCHEMBL7881965 0.72 SRD5A2 (0.47) PPARGLMNAL3MBTL1MAPTALDH1A1
SCHEMBL27474224 0.72 CNR1 (0.45) PLA2G2ANR1H4L3MBTL1ALDH1A1
SCHEMBL8887581 0.72 FFAR1 (0.58) LTA4HALOX5NR1H4LMNAL3MBTL1
SCHEMBL8888760 0.72 FFAR1 (0.58) LTA4HALOX5NR1H4LMNAL3MBTL1
SCHEMBL8890073 0.72 FFAR1 (0.58) LTA4HALOX5NR1H4LMNAL3MBTL1
SCHEMBL1115103 0.70 LTA4H (0.65) LTA4HNR1H4LMNAL3MBTL1ALDH1A1

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
CN-1161334-A Novel substd. guanidine derivs., process for prodn. thereof, and pharmaceutical uses thereof SUMITOMO PHARMA (JP) 1997-10-08 CN disclosed