SCHEMBL10547396

SCHEMBL10547396

CCOc1ccc(C(C)(C)CCCc2ccc(F)c(Oc3ccccc3)c2)cc1Br

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
HPGD P15428 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 4/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
ALPG P10696 1/20 0.33
NTRK1 P04629 1/20 0.33
NTRK3 Q16288 1/20 0.33
NTRK2 Q16620 1/20 0.33
PPARG P37231 1/20 0.33
ATM Q13315 1/20 0.33
TTR P02766 1/20 0.33
POLB P06746 1/20 0.32

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
SCHEMBL10739731 0.91 L3MBTL1 (0.37) MAPTL3MBTL1LMNAKMT2AALDH1A1
SCHEMBL10737754 0.90 VDR (0.39) MAPTL3MBTL1TDP1LMNAKMT2A
SCHEMBL10545086 0.90 TTR (0.34) PPARGTTR
SCHEMBL10544842 0.89 FDFT1 (0.33) PPARGTTR
SCHEMBL10546364 0.88 CALM1 (0.44) TTR
SCHEMBL10547822 0.88 FFAR1 (0.38) MAPTL3MBTL1SMN1; SMN2PPARGATM
SCHEMBL10544498 0.87 PPARG (0.32) PPARGTTR
SCHEMBL393264 0.87 LTA4H (0.43) MAPTL3MBTL1LMNAPPARGATM
SCHEMBL29363955 0.87 LTA4H (0.43) MAPTL3MBTL1LMNAPPARGATM
SCHEMBL10548601 0.86 TTR (0.34) PPARGTTR

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