SCHEMBL8024318

SCHEMBL8024318

CC(F)c1ncnc(NCc2ccc(Cl)cc2)c1Cl

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.51
TP53 P04637 2/20 0.49
MAPK1 P28482 1/20 0.48
CNR1 P21554 3/20 0.46
CNR2 P34972 1/20 0.46
PDE5A O76074 1/20 0.46
MAPT P10636 2/20 0.45
HTT P42858 1/20 0.44
LMNA P02545 3/20 0.44
POLB P06746 1/20 0.44
ACACB O00763 1/20 0.43
GAA P10253 1/20 0.43
ABL1 P00519 1/20 0.42
SRC P12931 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
LRRK2 Q5S007 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL8025185 0.90 PRMT1 (0.48) EGFRTP53MAPTHTTLMNA
SCHEMBL8026802 0.89 CDK1 (0.50) EGFRMAPK1PDE5AHTTLMNA
SCHEMBL8024781 0.87 HTT (0.55) EGFRTP53MAPK1PDE5AMAPT
SCHEMBL8014589 0.79 SLC6A4 (0.41) EGFRTP53CNR1CNR2MAPT
SCHEMBL9039173 0.78 CNR1 (0.48) TP53CNR1CNR2HTTLMNA
SCHEMBL8025396 0.77 CDK1 (0.50) EGFRMAPK1HTTLMNA
SCHEMBL9037270 0.77 GALR3 (0.59) EGFRTP53MAPK1MAPTHTT
SCHEMBL8401676 0.76 RAB9A (0.57) TP53HTTLMNAHSD17B10
SCHEMBL29176418 0.76 HTT (0.43) EGFRPDE5AMAPTHTTLMNA
SCHEMBL8485751 0.75 HTT (0.51) EGFRTP53MAPK1CNR1CNR2

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