SCHEMBL9053555

SCHEMBL9053555

C=CCc1ccc(OCc2ccccc2)s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.40
FFAR1 O14842 2/20 0.38
APOBEC3G Q9HC16 1/20 0.37
PPARG P37231 1/20 0.36
ALOX15 P16050 1/20 0.36
MAPK14 Q16539 1/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
PTGS1 P23219 1/20 0.36
SLC6A2 P23975 1/20 0.36
CYP2C19 P33261 1/20 0.36
PTGS2 P35354 1/20 0.36
SLC6A3 Q01959 1/20 0.36
HIF1A Q16665 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
TSHR P16473 1/20 0.35
MAPT P10636 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35

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
SCHEMBL1680711 0.78 MAOB (0.47) LTA4HFFAR1LMNACYP1A2PTGS1
SCHEMBL28147096 0.78 TSHR (0.54) LTA4HFFAR1LMNACYP1A2PTGS1
SCHEMBL12351987 0.70 LMNA (0.38) PPARGLMNACYP1A2PTGS1SLC6A2
SCHEMBL1680795 0.70 PPARG (0.48) LTA4HPPARGLMNACYP1A2PTGS1
SCHEMBL23121720 0.70 CD274 (0.63) LMNAL3MBTL1RAB9ASMN1; SMN2BCHE
SCHEMBL6292229 0.70 ALDH1A1 (0.34) PPARGALOX15CYP1A2TSHRMAPT
SCHEMBL30083980 0.69 LMNA (0.58) LTA4HFFAR1ALOX15LMNACYP1A2
SCHEMBL5879447 0.68 BCHE (0.47) MAPTL3MBTL1MAPK1TDP1GAA
SCHEMBL7805002 0.68 HTR1A (0.61) LMNASLC6A2MAPTL3MBTL1MAPK1
SCHEMBL4159497 0.68 PARP10 (0.51) FFAR1CYP1A2CYP2C19MAOBNR4A2

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
EP-0459406-B1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KK (JP) 1996-01-31 EP disclosed