SCHEMBL7950948

SCHEMBL7950948

CCOc1ccc(C(C)CC(C)Cc2ccc(F)c(Oc3ccccc3)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.43
CACNA1C Q13936 1/20 0.38
PTGS2 P35354 2/20 0.38
LMNA P02545 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SIGMAR1 Q99720 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
PPARG P37231 2/20 0.35
PPARD Q03181 2/20 0.35
PPARA Q07869 2/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
CNR2 P34972 1/20 0.35
POLB P06746 1/20 0.35
KAT6A Q92794 1/20 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
SCHEMBL8846649 0.83 LTA4H (0.43) LTA4HCACNA1CPTGS2LMNAMEN1
SCHEMBL9331962 0.81 LTA4H (0.43) LTA4HCACNA1CPTGS2LMNAMEN1
SCHEMBL9558992 0.81 LTA4H (0.41) LTA4HCACNA1CPTGS2LMNAMEN1
SCHEMBL6506489 0.80 SIGMAR1 (0.46) LTA4HCACNA1CSIGMAR1PPARGPPARD
SCHEMBL9331956 0.78 LTA4H (0.43) LTA4HLMNAL3MBTL1PPARGPPARD
SCHEMBL27851786 0.78 LTA4H (0.44) LTA4HCACNA1CPTGS2LMNAMEN1
SCHEMBL7929051 0.78 LTA4H (0.53) LTA4HCACNA1CPTGS2LMNAMEN1
SCHEMBL9801523 0.77 LTA4H (0.43) LTA4HCACNA1CLMNAMEN1KMT2A
SCHEMBL10835508 0.77 LTA4H (0.41) LTA4HCACNA1CPTGS2LMNAMEN1
SCHEMBL10549349 0.77 LTA4H (0.41) LTA4HCACNA1CLMNAMEN1KMT2A

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
US-6277867-B1 SYNERGISTIC MIXTURES CHINOIN GYOGYSZER ES VEGYESZETI (HU) 2001-08-21 US claimed