SCHEMBL2019257

SCHEMBL2019257

Fc1cccc(Cc2c(CCNc3ncnc4[nH]cnc34)ncc3ccccc23)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
MAPK1 P28482 3/20 0.41
HTT P42858 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
AURKA O14965 3/20 0.40
AURKB Q96GD4 2/20 0.40
ABL1 P00519 2/20 0.40
MAP4K4 O95819 2/20 0.40
BTK Q06187 2/20 0.40
DAPK3 O43293 1/20 0.40
JAK2 O60674 1/20 0.40
PRKD3 O94806 1/20 0.40
PAK4 O96013 1/20 0.40
LCK P06239 1/20 0.40
CSF1R P07333 1/20 0.40
RET P07949 1/20 0.40
PDGFRB P09619 1/20 0.40
FGFR1 P11362 1/20 0.40
PRKACA P17612 1/20 0.40
FLT1 P17948 1/20 0.40

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
SCHEMBL2016100 0.84 MAP4K4 (0.40) LMNAMAPK1HTTSMN1; SMN2AURKA
SCHEMBL20119671 0.80 AURKA (0.52) LMNAMAPK1HTTSMN1; SMN2AURKA
SCHEMBL2019256 0.74 MAP4K4 (0.42) LMNAMAPK1HTTSMN1; SMN2AURKA
SCHEMBL621253 0.74 CLK4 (0.67) AURKAAURKBABL1MAP4K4BTK
SCHEMBL2015901 0.73 MAPK1 (0.48) LMNAMAPK1HTTSMN1; SMN2AURKA
SCHEMBL9609211 0.71 MAPK1 (0.64) LMNAMAPK1HTTSMN1; SMN2MAPT
SCHEMBL2013612 0.70 PIK3CD (0.41) LMNAMAPK1HTTSMN1; SMN2AURKA
SCHEMBL2051140 0.69 PIK3CD (0.45) LMNAMAPK1HTTSMN1; SMN2AURKA
SCHEMBL17933849 0.69 HTT (0.49) LMNAMAPK1HTTSMN1; SMN2MAP4K4
SCHEMBL2717143 0.69 MAP4K4 (0.41) LMNAMAPK1HTTSMN1; SMN2AURKA

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
WO-2011075630-A1 SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2011-06-23 WO disclosed