SCHEMBL3364321

SCHEMBL3364321

Cc1cc(C#N)ccc1-c1ccnc(Cl)n1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 7/20 0.47
CYP11B1 P15538 3/20 0.40
CYP11B2 P19099 3/20 0.40
MAP3K14 Q99558 1/20 0.40
SCN9A Q15858 4/20 0.40
KCNH2 Q12809 3/20 0.40
EIF4E P06730 1/20 0.39
S1PR1 P21453 1/20 0.38

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
SCHEMBL13425430 0.82 MAP3K14 (0.59) EGLN2CYP11B1CYP11B2MAP3K14SCN9A
SCHEMBL446276 0.80 PIK3CA (0.43) MAP3K14SCN9A
SCHEMBL3361910 0.75 CYP11B2 (0.42) EGLN2CYP11B1CYP11B2SCN9AKCNH2
SCHEMBL30337173 0.75 EGFR (0.43) EGLN2MAP3K14SCN9A
SCHEMBL3393269 0.75 EGLN2 (0.41) EGLN2MAP3K14SCN9AKCNH2S1PR1
SCHEMBL17542577 0.75 EGFR (0.43) EGLN2MAP3K14SCN9A
SCHEMBL4378433 0.74 MEN1 (0.48) EGLN2CYP11B2
SCHEMBL3364557 0.74 CSNK1A1 (0.43) EGLN2CYP11B1CYP11B2SCN9AKCNH2
SCHEMBL24791485 0.74 KCNH2 (0.53) EGLN2KCNH2
SCHEMBL30872068 0.74 KCNH2 (0.53) EGLN2KCNH2

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
WO-2010046780-A2 ANTI VIRAL COMPOUNDS INSTITUT PASTEUR KOREA (KR) 2010-04-29 WO disclosed
WO-2010046780-A2 ANTI VIRAL COMPOUNDS INSTITUT PASTEUR KOREA (KR) 2010-04-29 WO disclosed