SCHEMBL6449192

SCHEMBL6449192

CO[Si](CCCNc1cccc(C)c1)(OC)OC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2D6 P10635 1/20 0.61
CYP2C9 P11712 1/20 0.61
CYP2C19 P33261 1/20 0.61
HTT P42858 1/20 0.61
ALDH1A1 P00352 3/20 0.47
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
GFER P55789 1/20 0.42
ACHE P22303 1/20 0.42
LMNA P02545 2/20 0.41
HPGD P15428 1/20 0.41
POLB P06746 1/20 0.41
F2 P00734 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ICMT O60725 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
SCHEMBL5685209 0.83 THRB (0.44) MAPTCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL959868 0.83 MTNR1A (0.43) MAPTCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL9617384 0.83 MTNR1A (0.47) MAPTCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL28828211 0.82 MAPT (0.57) MAPTCYP1A2CYP3A4CYP2C19ALDH1A1
SCHEMBL41158 0.82 MAPT (0.57) MAPTCYP1A2CYP3A4CYP2C19ALDH1A1
SCHEMBL11111034 0.81 MAPT (0.83) MAPTCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL14682409 0.81 MAPT (0.51) MAPTHTTALDH1A1LMNANPC1
SCHEMBL22393149 0.80 MAPT (0.55) MAPTCYP1A2CYP3A4CYP2C19ALDH1A1
Hydrochloric Acid SCHEMBL21813259 0.80 MAPT (0.55) MAPTCYP1A2CYP3A4CYP2C19ALDH1A1
Ammonia Solution, Strong SCHEMBL27657608 0.80 MAPT (0.55) MAPTCYP1A2CYP3A4CYP2C19ALDH1A1

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-20050171318-A1 Curable resin composition THE YOKOHAMA RUBBER CO., LTD. 2005-08-04 US disclosed