SCHEMBL9364376

SCHEMBL9364376

CC(Cl)c1ncnc(NC(C)c2ccc(Oc3ccccc3)cc2)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GALR3 O60755 1/20 0.44
NR2F2 P24468 1/20 0.44
TNF P01375 1/20 0.43
RAB9A P51151 1/20 0.43
NOD1 Q9Y239 1/20 0.43
EGFR P00533 13/20 0.41
KRAS P01116 1/20 0.41
SOS1 Q07889 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HTR7 P34969 1/20 0.40
ACACB O00763 1/20 0.40
ACACA Q13085 1/20 0.40
IDH1 O75874 1/20 0.39

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
SCHEMBL9403592 0.88 GALR3 (0.55) GALR3NR2F2TNFRAB9ANOD1
SCHEMBL9403591 0.83 EGFR (0.39) GALR3NR2F2TNFRAB9ANOD1
SCHEMBL12392376 0.78 EGFR (0.52) GALR3NR2F2TNFRAB9ANOD1
SCHEMBL7173840 0.78 GALR3 (0.55) GALR3NR2F2TNFRAB9ANOD1
SCHEMBL8028223 0.78 GALR3 (0.55) GALR3NR2F2TNFRAB9ANOD1
SCHEMBL7173846 0.78 GALR3 (0.55) GALR3NR2F2TNFRAB9ANOD1
SCHEMBL7173843 0.78 GALR3 (0.55) GALR3NR2F2TNFRAB9ANOD1
SCHEMBL9403586 0.77 GALR3 (0.51) GALR3NR2F2TNFRAB9ANOD1
SCHEMBL8024930 0.76 EGFR (0.48) GALR3NR2F2EGFRKRASSOS1
SCHEMBL8024509 0.75 EGFR (0.40) GALR3NR2F2TNFRAB9ANOD1

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
JP-6116247-A None JP disclosed
JP-H06116247-A ARALKYLAMINOPYRIMIDINE DERIVATIVE, ITS PRODUCTION AND PEST CONTROLLING AGENT UBE IND LTD 1994-04-26 JP disclosed