SCHEMBL9741013

SCHEMBL9741013

CCc1ncnc(Cl)c1SCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ICAM1 P05362 1/20 0.42
SELE P16581 1/20 0.42
VCAM1 P19320 1/20 0.42
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 6/20 0.41
HTT P42858 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
NR2E3 Q9Y5X4 1/20 0.40
PKM P14618 4/20 0.39
LMNA P02545 3/20 0.39
HPGD P15428 3/20 0.39
MAPT P10636 3/20 0.39
NPSR1 Q6W5P4 3/20 0.39
PPARG P37231 2/20 0.39
NCOA2 Q15596 2/20 0.39
NCOA1 Q15788 2/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL9426904 0.85 HSD17B10 (0.50) HSD17B10ALDH1A1HTTTDP1SMN1; SMN2
SCHEMBL9741411 0.83 ICAM1 (0.43) ICAM1SELEVCAM1HSD17B10ALDH1A1
SCHEMBL9741908 0.79 NR2E3 (0.46) ICAM1SELEVCAM1HSD17B10ALDH1A1
SCHEMBL9741437 0.78 NR2E3 (0.45) ICAM1SELEVCAM1HSD17B10ALDH1A1
SCHEMBL9741863 0.74 NPSR1 (0.39) ICAM1SELEVCAM1HSD17B10ALDH1A1
SCHEMBL857100 0.73 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2LMNAHPGDTP53
SCHEMBL9427014 0.72 HSD17B10 (0.50) HSD17B10ALDH1A1HTTTDP1SMN1; SMN2
SCHEMBL9740941 0.71 NPSR1 (0.41) HSD17B10ALDH1A1HTTTDP1SMN1; SMN2
SCHEMBL9427382 0.70 NR2E3 (0.48) ICAM1SELEVCAM1HSD17B10ALDH1A1
SCHEMBL31120582 0.69 POLB (0.47) HSD17B10ALDH1A1TDP1SMN1; SMN2RAB9A

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
WO-1992006965-A1 HERBICIDAL SULFONYLUREA DERIVATIVES ICI AUSTRALIA OPERATIONS PROPRIETARY LIMITED (AU) 1992-04-30 WO disclosed