SCHEMBL20548786

SCHEMBL20548786

C=CC(=O)Nc1cc(Nc2cc(Nc3cc(OC)c(Cl)cc3Cl)ncn2)c(OC)cc1N(C)CC(C)(C)N

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.48
KDR P35968 1/20 0.45
EML4 Q9HC35 5/20 0.45
ALK Q9UM73 5/20 0.45
FGFR1 P11362 2/20 0.44
ERBB2 P04626 1/20 0.44
INSR P06213 1/20 0.44
ROS1 P08922 1/20 0.44
FER P16591 1/20 0.44
LTK P29376 1/20 0.44
BLK P51451 1/20 0.44
PTK2 Q05397 1/20 0.44
BTK Q06187 1/20 0.44
TNK2 Q07912 1/20 0.44
ERBB4 Q15303 1/20 0.44
SLK Q9H2G2 1/20 0.44
FGFR4 P22455 1/20 0.44
FGFR2 P21802 1/20 0.44
FGFR3 P22607 1/20 0.44

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
SCHEMBL19089670 0.87 EGFR (0.61) EGFREML4ALK
SCHEMBL35210347 0.87 EGFR (0.61) EGFREML4ALK
SCHEMBL20549061 0.87 EGFR (0.48) EGFRKDREML4ALKFGFR1
SCHEMBL20548969 0.86 EGFR (0.54) EGFRKDREML4ALKERBB2
SCHEMBL20548845 0.85 EGFR (0.46) EGFREML4ALKFGFR1FGFR2
SCHEMBL20548863 0.85 EGFR (0.46) EGFREML4ALKFGFR1FGFR4
SCHEMBL20548788 0.82 EGFR (0.45) EGFREML4ALK
SCHEMBL20548849 0.82 EGFR (0.53) EGFREML4ALK
SCHEMBL20549034 0.81 FGFR1 (0.48) EGFRFGFR1
SCHEMBL20548738 0.81 EGFR (0.49) EGFREML4ALK

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-3398939-A1 ACRYLANILIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATIONS THEREOF IN PHARMACY Ancureall Pharmaceutical (Shanghai) Co., Ltd. (CN) 2018-11-07 EP claimed
EP-3398939-A1 ACRYLANILIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATIONS THEREOF IN PHARMACY Ancureall Pharmaceutical (Shanghai) Co., Ltd. (CN) 2018-11-07 EP disclosed