SCHEMBL15080025

SCHEMBL15080025

COc1ccccc1CCOc1ccccc1F

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.67
TDP1 Q9NUW8 1/20 0.67
TAAR1 Q96RJ0 1/20 0.58
ALDH1A1 P00352 2/20 0.50
MAPT P10636 1/20 0.49
MAPK1 P28482 1/20 0.49
ABCB1 P08183 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
AOC3 Q16853 1/20 0.47
KCNH2 Q12809 1/20 0.46
TTR P02766 1/20 0.46
MEN1 O00255 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
RECQL P46063 1/20 0.45
KMT2A Q03164 1/20 0.45
HRH3 Q9Y5N1 1/20 0.45
IDO1 P14902 1/20 0.44

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
SCHEMBL15079979 0.83 L3MBTL1 (0.56) L3MBTL1TDP1TAAR1ALDH1A1MAPT
SCHEMBL15079783 0.79 MPO (0.49) L3MBTL1TDP1TAAR1ALDH1A1MAPT
SCHEMBL7503352 0.79 ADORA2A (0.45) L3MBTL1TDP1TAAR1ABCB1MEN1
SCHEMBL9854725 0.79 TAAR1 (0.56) L3MBTL1TAAR1MAPTABCB1SIGMAR1
SCHEMBL792023 0.77 TAAR1 (0.64) L3MBTL1TAAR1ALDH1A1MAPTABCB1
SCHEMBL9190330 0.77 TAAR1 (0.64) TAAR1ALDH1A1MAPTABCB1SIGMAR1
SCHEMBL15079417 0.77 MAPT (0.61) L3MBTL1TDP1TAAR1MAPTABCB1
SCHEMBL28858018 0.77 TAAR1 (0.75) TAAR1ALDH1A1MAPTABCB1SIGMAR1
SCHEMBL1825357 0.76 L3MBTL1 (0.67) L3MBTL1TDP1ALDH1A1MAPTMAPK1
SCHEMBL29466747 0.74

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
WO-2013093320-A1 NOVEL ANTI-AGING AND DEPIGMENTING COSMETIC COMPOSITIONS DIVERCHIM (FR) 2013-06-27 WO disclosed