SCHEMBL11856502

SCHEMBL11856502

CCOC(Oc1ccc(Oc2ccccc2)cc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 7/20 0.52
PPARG P37231 4/20 0.42
PPARA Q07869 4/20 0.42
PPARD Q03181 2/20 0.42
TSHR P16473 1/20 0.41
FFAR1 O14842 1/20 0.40
NPC1 O15118 1/20 0.40
HPGD P15428 1/20 0.40
CRHBP P24387 1/20 0.40
RAB9A P51151 1/20 0.40
CRHR2 Q13324 1/20 0.40
SLC6A4 P31645 1/20 0.39
NPY5R Q15761 1/20 0.39
NR1H2 P55055 1/20 0.38
BAX Q07812 1/20 0.38
MAOA P21397 1/20 0.38
PTGS1 P23219 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
SCHEMBL11042749 0.87 LTA4H (0.57) LTA4HPPARGPPARAPPARDTSHR
SCHEMBL10182877 0.82 SLC7A5 (0.53) TSHRFFAR1NPC1RAB9ASLC6A4
SCHEMBL8678809 0.81 SLC6A4 (0.35) TSHRSLC6A4
SCHEMBL7181023 0.81 MEN1 (0.41) TSHRNPC1RAB9ASLC6A4
SCHEMBL11844525 0.80 LTA4H (0.52) LTA4HPPARGPPARATSHRHPGD
SCHEMBL25685898 0.80 LTB4R (0.39) FFAR1SLC6A4
SCHEMBL27191 0.79 ACHE (0.47) TSHRSLC6A4
SCHEMBL11553424 0.79 PPARG (0.38) LTA4HPPARGPPARATSHRRAB9A
SCHEMBL11555379 0.79 PPARG (0.38) LTA4HPPARGPPARATSHRNR1H2
SCHEMBL11697237 0.79 LTA4H (0.55) LTA4HPPARGPPARAPPARDTSHR

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-3987102-A PHENOXY (BENZYLOXY) BENZENE DERIVATIVES CIBA-GEIGY CORPORATION (US) 1976-10-19 US claimed