SCHEMBL8024890

SCHEMBL8024890

CC(F)c1ncnc(NC(C)c2ccc(SC(F)F)cc2)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.38
RAB9A P51151 2/20 0.38
HSD17B10 Q99714 2/20 0.38
NPC1 O15118 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
GALR3 O60755 1/20 0.37
NR2F2 P24468 1/20 0.37
CNR1 P21554 4/20 0.37
CNR2 P34972 4/20 0.37
LMNA P02545 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
EGFR P00533 10/20 0.36
TNF P01375 1/20 0.34
NOD1 Q9Y239 1/20 0.34
P2RX3 P56373 1/20 0.34

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
SCHEMBL8014117 0.88 GALR3 (0.38) SMN1; SMN2RAB9AHSD17B10GALR3NR2F2
SCHEMBL9787313 0.87 SMN1; SMN2 (0.38) SMN1; SMN2RAB9AHSD17B10NPC1MAPK1
SCHEMBL8014557 0.85 EGFR (0.37) SMN1; SMN2RAB9AHSD17B10GALR3NR2F2
SCHEMBL9836824 0.84 SMN1; SMN2 (0.36) SMN1; SMN2RAB9AHSD17B10NPC1MAPK1
SCHEMBL8026760 0.83 CNR1 (0.35) SMN1; SMN2RAB9AHSD17B10GALR3NR2F2
SCHEMBL8024317 0.83 EGFR (0.49) SMN1; SMN2RAB9AHSD17B10GALR3NR2F2
SCHEMBL7173846 0.82 GALR3 (0.55) SMN1; SMN2RAB9AHSD17B10GALR3NR2F2
SCHEMBL7173840 0.82 GALR3 (0.55) SMN1; SMN2RAB9AHSD17B10GALR3NR2F2
SCHEMBL8028223 0.82 GALR3 (0.55) SMN1; SMN2RAB9AHSD17B10GALR3NR2F2
SCHEMBL7173843 0.82 GALR3 (0.55) SMN1; SMN2RAB9AHSD17B10GALR3NR2F2

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