SCHEMBL3390161

SCHEMBL3390161

Cc1ccc(-n2nc(C(C)(C)C)cc2N(OS(C)(=O)=O)C(=O)Nc2ccc(OC3CCN(C(=O)c4ccc(F)cc4F)CC3)nc2C)cc1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.34
MAPK1 P28482 1/20 0.34
GPR119 Q8TDV5 2/20 0.34
TRPV1 Q8NER1 2/20 0.34
PTK2B Q14289 1/20 0.34
MAPK14 Q16539 4/20 0.33
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32
GPR6 P46095 3/20 0.32
OPRM1 P35372 1/20 0.32
NR1I2 O75469 1/20 0.32
CACNA1B Q00975 1/20 0.32

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
SCHEMBL3388916 0.93 MAPK14 (0.38) MAPK1GPR119TRPV1PTK2BMAPK14
SCHEMBL3388858 0.90 MAPK14 (0.37) GPR119TRPV1PTK2BMAPK14MAPK13
SCHEMBL3390664 0.88 BRAF (0.35) SMN1; SMN2MAPK1TRPV1PTK2BMAPK14
SCHEMBL3390159 0.86 MAPK14 (0.48) PTK2BMAPK14MAPK13MAPK12MAPK11
SCHEMBL3392618 0.84 MAPK14 (0.51) PTK2BMAPK14MAPK13MAPK12MAPK11
SCHEMBL3392832 0.83 BRAF (0.35) TRPV1PTK2BMAPK14MAPK13MAPK12
SCHEMBL3393250 0.81 MAPK12 (0.40) SMN1; SMN2PTK2BMAPK14MAPK13MAPK12
SCHEMBL3394286 0.79 LMNA (0.37) SMN1; SMN2MAPK1TRPV1PTK2BMAPK14
SCHEMBL3388913 0.79 MAPK14 (0.55) MAPK1PTK2BMAPK14MAPK13MAPK12
SCHEMBL3422290 0.78 MAPK14 (0.37) SMN1; SMN2TRPV1PTK2BMAPK14MAPK13

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
EP-1943243-B1 KINASE INHIBITORS LILLY CO ELI (US) 2010-12-29 EP disclosed