SCHEMBL4187578

SCHEMBL4187578

ClCCOc1ccc[c]c1Cl

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.33
KDM4E B2RXH2 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MAPT P10636 2/20 0.31
JAK2 O60674 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
MEN1 O00255 1/20 0.31
PKM P14618 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TSHR P16473 1/20 0.30
TP53 P04637 1/20 0.30
MAPK1 P28482 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL2968626 0.83 NPC1 (0.41) KCNH2KDM4EL3MBTL1MAPTGAA
SCHEMBL28812235 0.83 IDO1 (0.40) KCNH2MAPTJAK2LMNAGAA
SCHEMBL17046388 0.81 L3MBTL1 (0.40) KCNH2KDM4EL3MBTL1MAPTJAK2
SCHEMBL2971838 0.81 CYP1A2 (0.49) KCNH2L3MBTL1MAPTLMNAMEN1
SCHEMBL920555 0.79 KDM4E (0.35) KDM4EL3MBTL1MAPTJAK2LMNA
SCHEMBL20797097 0.79 HTR7 (0.51) KDM4EMAPTALDH1A1SMN1; SMN2
SCHEMBL9532654 0.78 DRD1 (0.38)
SCHEMBL1069301 0.78 ALDH1A1 (0.44) KDM4EL3MBTL1MAPTLMNAGAA
SCHEMBL20797181 0.76 DRD3 (0.49) KCNH2KDM4EMAPTLMNAMEN1
SCHEMBL9732356 0.75 ALDH1A1 (0.56) MAPTLMNAGAAMEN1PKM

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101466678-B Substituted 3-cyanopyridines as protein kinase inhibitors WYETH CORP 2012-12-26 CN disclosed
CN-101466678-A Substituted 3-cyanopyridines as protein kinase inhibitors WYETH CORP (US) 2009-06-24 CN disclosed
CN-101454287-A Substituted cyanopyridines as protein kinase inhibitors WYETH CORP (US) 2009-06-10 CN disclosed
EP-2027093-A2 SUBSTITUTED CYANOPYRIDINES AS PROTEIN KINASE INHIBITORS Wyeth (US) 2009-02-25 EP disclosed
WO-2007146323-A2 SUBSTITUTED CYANOPYRIDINES AS PROTEIN KINASE INHIBITORS WYETH (US) 2007-12-21 WO disclosed