SCHEMBL8026893

SCHEMBL8026893

Cc1cc(C(C)Nc2ncnc(C(C)F)c2Cl)cc(C)c1OC(F)F

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.37
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SLC34A1 Q06495 1/20 0.32
CNR1 P21554 4/20 0.32
CNR2 P34972 4/20 0.32
KRAS P01116 1/20 0.32
SOS1 Q07889 1/20 0.32
GALR3 O60755 1/20 0.31
NR2F2 P24468 1/20 0.31
PDPK1 O15530 1/20 0.30
RPS6KB1 P23443 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
SCHEMBL8024509 0.80 EGFR (0.40) EGFRMEN1KMT2ACNR1CNR2
SCHEMBL8024922 0.79 EGFR (0.42) EGFRMEN1KMT2ACNR1CNR2
SCHEMBL8025390 0.79 EGFR (0.42) EGFRCNR1CNR2KRASSOS1
SCHEMBL8014129 0.77 EGFR (0.43) EGFRKRASSOS1RPS6KB1
SCHEMBL8028223 0.75 GALR3 (0.55) EGFRKRASSOS1GALR3NR2F2
SCHEMBL7173846 0.75 GALR3 (0.55) EGFRKRASSOS1GALR3NR2F2
SCHEMBL7173843 0.75 GALR3 (0.55) EGFRKRASSOS1GALR3NR2F2
SCHEMBL7173840 0.75 GALR3 (0.55) EGFRKRASSOS1GALR3NR2F2
SCHEMBL8024930 0.73 EGFR (0.48) EGFRCNR1CNR2KRASSOS1
SCHEMBL8014573 0.73 LMNA (0.47) EGFRCNR1CNR2KRASSOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0543402-B1 Aralkylaminopyrimidine derivative, method for preparing the same and composition for controlling noxious organisms UBE INDUSTRIES (JP) 2000-03-01 EP claimed
US-5280025-A Aralkylaminopyrimidine derivative, and chemical for controlling noxious organisms containing the same UBE INDUSTRIES, LTD. (JP) 1994-01-18 US claimed
EP-0543402-A1 Aralkylaminopyrimidine derivative, method for preparing the same and chemical for controlling noxious organisms containing the same UBE INDUSTRIES, LTD. (JP) 1993-05-26 EP claimed