SCHEMBL19718754

SCHEMBL19718754

Cc1cc(F)cc(-c2csc(N)n2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
KDM4E B2RXH2 3/20 0.58
ALDH1A1 P00352 9/20 0.56
RAB9A P51151 7/20 0.56
ALOX5 P09917 1/20 0.56
NPC1 O15118 6/20 0.48
SMN1; SMN2 Q16637 6/20 0.48
LTA4H P09960 3/20 0.47
MPL P40238 1/20 0.45
NFKB1 P19838 2/20 0.44
GFER P55789 2/20 0.44
NFKB2 Q00653 2/20 0.44
RELA Q04206 2/20 0.44
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
AR P10275 1/20 0.44
HSD17B10 Q99714 2/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL480736 0.87 MAPT (0.68) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL27985361 0.87 LTA4H (0.54) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL22290249 0.79 RAB9A (0.58) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL17407196 0.79 LTA4H (0.55) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL17407200 0.79 ALDH1A1 (0.58) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL17549001 0.77 LTA4H (0.53) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL474188 0.77 MAPT (0.55) MAPTMEN1KMT2AKDM4EALDH1A1
Bromide SCHEMBL8360770 0.76 MAPT (0.54) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL17386917 0.75 RAB9A (0.44) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL1689576 0.75 RAB9A (0.66) MAPTMEN1KMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9844549-B2 2-aminothiazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2017-12-19 US disclosed