SCHEMBL8244182

SCHEMBL8244182

CCOC(=O)c1cn(-c2cccc(CCC(C)(C)[Si](C)(C)O)c2)cn1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.53
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP1A2 P05177 1/20 0.37
GABRA2 P47869 4/20 0.37
GABRB2 P47870 4/20 0.37
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
GRM5 P41594 1/20 0.36
GAA P10253 3/20 0.35
TGFBR1 P36897 1/20 0.35
CPB2 Q96IY4 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL1880494 0.82 NOTUM (0.63) NOTUMHPGDSMN1; SMN2CYP1A2GABRA2
SCHEMBL1890673 0.81 NOTUM (0.54) NOTUMHPGDSMN1; SMN2CYP1A2GABRA2
SCHEMBL12191258 0.78 NOTUM (0.67) NOTUMHPGDSMN1; SMN2CYP1A2GABRA2
SCHEMBL1878934 0.77 NOTUM (0.63) NOTUMCYP1A2GABRA2GABRB2KMT2A
SCHEMBL9827734 0.77 NOTUM (0.73) NOTUMSMN1; SMN2CYP1A2GABRA2GABRB2
SCHEMBL9464564 0.77 NOTUM (0.66) NOTUMHPGDSMN1; SMN2CYP1A2GABRA2
Hydrochloric Acid SCHEMBL1878932 0.76 NOTUM (0.62) NOTUMCYP1A2GABRA2GABRB2KMT2A
SCHEMBL9464637 0.76 NOTUM (0.65) NOTUMHPGDSMN1; SMN2CYP1A2GABRA2
SCHEMBL1881082 0.76 NOTUM (0.65) NOTUMSMN1; SMN2CYP1A2GABRA2GABRB2
SCHEMBL12214546 0.76 NOTUM (0.65) NOTUMHPGDSMN1; SMN2CYP1A2GABRA2

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-2007042545-A1 IMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABA-A RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 2007-04-19 WO disclosed