SCHEMBL10548673

SCHEMBL10548673

Cc1cccc(C(C)(C)CCCc2cccc(Oc3ccc(F)cc3)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 7/20 0.44
ALDH1A1 P00352 1/20 0.39
FFAR1 O14842 2/20 0.38
MPO P05164 1/20 0.37
PPARA Q07869 3/20 0.37
PPARD Q03181 1/20 0.37
CETP P11597 1/20 0.37
PPARG P37231 2/20 0.36
NR3C1 P04150 2/20 0.36
CACNA1B Q00975 1/20 0.36
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL9558486 0.89 FDFT1 (0.45) FDFT1FFAR1MPOPPARAPPARD
SCHEMBL10549878 0.89 FDFT1 (0.47) FDFT1ALDH1A1NR3C1HTT
SCHEMBL9558443 0.89 FDFT1 (0.48) FDFT1MPOPPARAPPARDCETP
SCHEMBL10544342 0.88 FDFT1 (0.45) FDFT1PPARAPPARDCETPPPARG
SCHEMBL9559108 0.88 FDFT1 (0.44) FDFT1PPARAPPARDCETPPPARG
SCHEMBL10549856 0.86 FDFT1 (0.43) FDFT1PPARAPPARDCETPPPARG
SCHEMBL10547992 0.86 FDFT1 (0.51) FDFT1ALDH1A1MPOPPARAPPARD
SCHEMBL10547084 0.85 FDFT1 (0.45) FDFT1NR3C1
SCHEMBL10547508 0.85 FDFT1 (0.42) FDFT1PPARAPPARDCETPPPARG
SCHEMBL10545884 0.85 FDFT1 (0.44) FDFT1MPOPPARAPPARDCETP

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4814340-A 1,4-diaryl alkane derivatives having insecticidal and acaricidal activity MITSUI TOATSU CHEMICALS, INC. (JP) 1989-03-21 US disclosed
US-4661501-A Certain aryl-alkane-2-pyridyloxy-phenyl derivatives having insecticidal and acaricidal activity MITSUI TOATSU CHEMICALS, INC. (JP) 1987-04-28 US disclosed