SCHEMBL2934935

SCHEMBL2934935

C=Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)CC2)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.47
VEGFA P15692 1/20 0.46
EGLN1 Q9GZT9 1/20 0.46
GPR119 Q8TDV5 6/20 0.44
F13A1 P00488 2/20 0.43
TGM2 P21980 2/20 0.43
TGM1 P22735 2/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43
NSD2 O96028 1/20 0.43
TP53 P04637 2/20 0.42
THRB P10828 1/20 0.42
MAPT P10636 1/20 0.42
IDO1 P14902 1/20 0.42
TDO2 P48775 1/20 0.42
IDO2 Q6ZQW0 1/20 0.42

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
SCHEMBL114519 0.86 VEGFA (0.50) MEN1KMT2AATMVEGFAEGLN1
SCHEMBL30520640 0.84 MEN1 (0.50) MEN1KMT2AATMVEGFAEGLN1
SCHEMBL30584532 0.83 MEN1 (0.49) MEN1KMT2AATMVEGFAEGLN1
SCHEMBL12557699 0.83 KMT2A (0.69) MEN1KMT2AATMVEGFAEGLN1
SCHEMBL1997213 0.83 MEN1 (0.49) MEN1KMT2AATMVEGFAEGLN1
SCHEMBL2933302 0.83 MEN1 (0.49) MEN1KMT2AATMVEGFAEGLN1
SCHEMBL30042412 0.83 MEN1 (0.49) MEN1KMT2AATMVEGFAEGLN1
SCHEMBL18038932 0.83 VEGFA (0.52) MEN1KMT2AVEGFAEGLN1CHRM2
SCHEMBL209280 0.82 TBK1 (0.55) MEN1KMT2AATMVEGFAEGLN1
SCHEMBL31298334 0.82 MEN1 (0.51) MEN1KMT2AATMVEGFAEGLN1

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
EP-2229377-A1 5-ALKYL/ALKENYL-3-CYANOPYRIDINES AS KINASE INHIBITORS Wyeth LLC (US) 2010-09-22 EP disclosed
WO-2009076602-A1 5-ALKYL/ALKENYL-3-CYANOPYRIDINES AS KINASE INHIBITORS WYETH (US) 2009-06-18 WO disclosed