SCHEMBL8014117

SCHEMBL8014117

CSc1ccc(C(C)Nc2ncnc(C(C)F)c2Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GALR3 O60755 1/20 0.38
NR2F2 P24468 1/20 0.38
CNR1 P21554 3/20 0.38
CNR2 P34972 3/20 0.38
EGFR P00533 11/20 0.37
TNF P01375 1/20 0.35
RAB9A P51151 1/20 0.35
NOD1 Q9Y239 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KRAS P01116 1/20 0.34
SOS1 Q07889 1/20 0.34
P2RX3 P56373 1/20 0.34
ACACB O00763 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
SCHEMBL8024890 0.88 SMN1; SMN2 (0.38) GALR3NR2F2CNR1CNR2EGFR
SCHEMBL8030300 0.88 GALR3 (0.37) GALR3NR2F2CNR1CNR2EGFR
SCHEMBL8014557 0.86 EGFR (0.37) GALR3NR2F2CNR1CNR2EGFR
SCHEMBL8026760 0.84 CNR1 (0.35) GALR3NR2F2CNR1CNR2EGFR
SCHEMBL9617680 0.84 GALR3 (0.40) GALR3NR2F2CNR1CNR2EGFR
SCHEMBL8024317 0.84 EGFR (0.49) GALR3NR2F2CNR1CNR2EGFR
SCHEMBL7173840 0.83 GALR3 (0.55) GALR3NR2F2EGFRTNFRAB9A
SCHEMBL7173843 0.83 GALR3 (0.55) GALR3NR2F2EGFRTNFRAB9A
SCHEMBL7173846 0.83 GALR3 (0.55) GALR3NR2F2EGFRTNFRAB9A
SCHEMBL8028223 0.83 GALR3 (0.55) GALR3NR2F2EGFRTNFRAB9A

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 6 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
EP-0543402-B1 Aralkylaminopyrimidine derivative, method for preparing the same and composition for controlling noxious organisms UBE INDUSTRIES (JP) 2000-03-01 EP disclosed
US-5280025-A Aralkylaminopyrimidine derivative, and chemical for controlling noxious organisms containing the same UBE INDUSTRIES, LTD. (JP) 1994-01-18 US disclosed
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 disclosed