SCHEMBL10547464

SCHEMBL10547464

CCC(C)(CCCc1cccc(Oc2ccccc2)c1)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 6/20 0.47
CETP P11597 1/20 0.41
MAPK14 Q16539 2/20 0.41
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
CYP2C9 P11712 1/20 0.39
RAB9A P51151 1/20 0.39
PPARG P37231 4/20 0.39
PPARA Q07869 3/20 0.39
PPARD Q03181 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
LTA4H P09960 1/20 0.39
EPHX2 P34913 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALOX5 P09917 1/20 0.39
PSEN1 P49768 1/20 0.39

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
SCHEMBL10544536 0.93 FDFT1 (0.46) FDFT1NPC1POLBCYP2C9RAB9A
SCHEMBL9558003 0.91 FDFT1 (0.46) FDFT1NPC1POLBCYP2C9RAB9A
SCHEMBL10547498 0.90 FDFT1 (0.49) FDFT1NPC1POLBCYP2C9RAB9A
SCHEMBL10543647 0.90 CETP (0.42) FDFT1CETPMAPK14NPC1POLB
SCHEMBL10548418 0.89 FDFT1 (0.43) FDFT1NPC1POLBCYP2C9RAB9A
SCHEMBL10546909 0.88 FDFT1 (0.42) FDFT1NPC1POLBCYP2C9RAB9A
SCHEMBL9558187 0.88 KDM4E (0.50) FDFT1NPC1POLBCYP2C9RAB9A
SCHEMBL9559051 0.88 ALDH1A1 (0.44) FDFT1NPC1POLBCYP2C9RAB9A
SCHEMBL10547619 0.87 LTA4H (0.49) FDFT1CETPNPC1POLBCYP2C9
SCHEMBL10549355 0.87 CETP (0.47) FDFT1CETP

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