SCHEMBL17066288

SCHEMBL17066288

CC(C)(C)c1ncc(-c2ccc(-c3ccc4[nH]c(C(C)(C)C)nc4c3)cc2)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 9/20 0.43
KCNH2 Q12809 6/20 0.39
SCN1A P35498 1/20 0.39
SCN5A Q14524 1/20 0.39
SCN9A Q15858 1/20 0.39
SCN2A Q99250 1/20 0.39
SCN8A Q9UQD0 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TGFBR1 P36897 1/20 0.34
MTOR P42345 1/20 0.34
SSTR3 P32745 1/20 0.34
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
GFER P55789 1/20 0.33

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
SCHEMBL23619188 0.85 ALDH1A1 (0.47) SCN10AKCNH2L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL17066290 0.76 SCN10A (0.53) SCN10AKCNH2SCN1ASCN5ASCN9A
SCHEMBL15007948 0.74 SCN10A (0.54) SCN10AKCNH2SCN1ASCN5ASCN9A
SCHEMBL5949923 0.74 SCN10A (0.54) SCN10AKCNH2SCN1ASCN5ASCN9A
SCHEMBL17066708 0.72 CYP2A6 (0.43) ALDH1A1SMN1; SMN2NPC1POLBRAB9A
SCHEMBL12549011 0.72 SCN10A (0.76) SCN10AKCNH2SCN1ASCN5ASCN9A
SCHEMBL1690431 0.72 SCN2A (0.55) SCN10AKCNH2SCN1ASCN5ASCN9A
SCHEMBL846855 0.71 SCN10A (0.58) SCN10AKCNH2L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL10005347 0.71 ALDH1A1 (0.46) SCN10AKCNH2L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL18506235 0.70 SCN10A (0.54) SCN10AKCNH2SCN1ASCN5ASCN9A

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-9125904-B1 Biphenyl imidazoles and related compounds useful for treating HCV infections ACHILLION PHARMACEUTICALS, INC. (US) 2015-09-08 US disclosed