SCHEMBL14399298

SCHEMBL14399298

O=C(O)c1cnc2ccsc2c1CI

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CAMKK1 Q8N5S9 1/20 0.37
CAMKK2 Q96RR4 1/20 0.37
SPR P35270 2/20 0.36
PDPK1 O15530 1/20 0.35
PARP1 P09874 1/20 0.35
CHEK1 O14757 1/20 0.35
LIMK1 P53667 1/20 0.35
DYRK1A Q13627 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
ALDH1A1 P00352 6/20 0.34
CSNK2A2 P19784 1/20 0.33
CSNK2B P67870 1/20 0.33
CSNK2A1 P68400 1/20 0.33
AXL P30530 1/20 0.33
MKNK1 Q9BUB5 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA2B P29275 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
SCHEMBL14399296 0.81 ALDH1A1 (0.44) MEN1KMT2AALDH1A1
SCHEMBL4543435 0.78 GPR35 (0.41) MEN1KMT2ACAMKK1CAMKK2SPR
SCHEMBL10406124 0.78 KMT2A (0.41) MEN1KMT2ACAMKK1CAMKK2SPR
SCHEMBL4900637 0.76 AXL (0.43) MEN1KMT2ACAMKK1CAMKK2SPR
SCHEMBL15736808 0.76 SPR (0.46) MEN1KMT2ACAMKK1CAMKK2SPR
SCHEMBL11277616 0.70 KDR (0.44) MEN1KMT2ACAMKK1CAMKK2SPR
SCHEMBL27301289 0.70 PDE4A (0.53) ALDH1A1ADORA2AADORA2BPDE4APDE4B
SCHEMBL11086602 0.69 ALDH1A1 (0.41) MEN1KMT2AALDH1A1CSNK2A1ADORA2A
SCHEMBL2881001 0.67 ADORA2A (0.57) MEN1KMT2ACAMKK1CAMKK2PDPK1
SCHEMBL30528561 0.67 MEN1 (0.47) MEN1KMT2AALDH1A1CSNK2A1

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-7276519-B2 Thieno[3,2-b]pyridine-6-carbonitriles and thieno[2,3-b]pyridine-5-carbonitriles as protein kinase inhibitors WYETH (US) 2007-10-02 US disclosed