SCHEMBL13714728

SCHEMBL13714728

Nc1nc(-c2ccsc2)cn1-c1nc(-c2ccsc2)cs1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.51
BACE1 P56817 2/20 0.36
CSNK2A1 P68400 2/20 0.36
FYN P06241 1/20 0.35
CLK4 Q9HAZ1 2/20 0.34
JAK2 O60674 1/20 0.34
PRKD3 O94806 1/20 0.34
ABL1 P00519 1/20 0.34
EGFR P00533 1/20 0.34
ERBB2 P04626 1/20 0.34
LCK P06239 1/20 0.34
CDK1 P06493 1/20 0.34
CSF1R P07333 1/20 0.34
LYN P07948 1/20 0.34
RET P07949 1/20 0.34
KIT P10721 1/20 0.34
FGFR1 P11362 1/20 0.34
FER P16591 1/20 0.34
FLT1 P17948 1/20 0.34
FGFR3 P22607 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
SCHEMBL13714609 0.93 AR (0.46) ARCSNK2A1CLK4JAK2PRKD3
SCHEMBL13714563 0.82 ALDH1A1 (0.54) ARCSNK2A1CLK4JAK2PRKD3
SCHEMBL13714837 0.75 AR (0.52) AREGFRALDH1A1NPY5RTP53
SCHEMBL3860803 0.74 CYP3A4 (0.47) ARCSNK2A1CLK4JAK2PRKD3
SCHEMBL13714602 0.74 HSD17B10 (0.50) ARCSNK2A1CLK4JAK2PRKD3
SCHEMBL9748435 0.73 ALDH1A1 (0.59) ARMKNK2ALDH1A1TP53ALOX15
SCHEMBL13714838 0.73 RAB9A (0.56) ARCSNK2A1CLK4JAK2PRKD3
SCHEMBL13714593 0.71 MAPT (0.50) ARCSNK2A1CLK4JAK2PRKD3
SCHEMBL13714604 0.71 RAB9A (0.50) ARCSNK2A1CLK4JAK2PRKD3
SCHEMBL17014767 0.70 AR (0.74) ARALDH1A1TP53ALOX15SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7569596-B2 Imidazolamino compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-08-04 US disclosed
US-7569596-B2 Imidazolamino compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-08-04 US disclosed
US-7462723-B2 Imidazolamino compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2008-12-09 US disclosed
US-7462723-B2 Imidazolamino compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2008-12-09 US disclosed