SCHEMBL7073889

SCHEMBL7073889

O=[N+]([O-])c1ccc(CS)c(Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.60
IDO1 P14902 1/20 0.52
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 3/20 0.48
VCAM1 P19320 1/20 0.46
PDE7A Q13946 5/20 0.45
TDP1 Q9NUW8 1/20 0.44
CYP1A2 P05177 1/20 0.44
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4D Q08499 1/20 0.43
PDE7B Q9NP56 1/20 0.43
TSHR P16473 1/20 0.42

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
SCHEMBL23883005 0.86 HSD17B10 (0.56) HSD17B10KMT2AALDH1A1VCAM1PDE7A
SCHEMBL30002362 0.86 HSD17B10 (0.56) HSD17B10KMT2AALDH1A1VCAM1PDE7A
SCHEMBL2205749 0.83 HSD17B10 (0.62) HSD17B10KMT2AALDH1A1VCAM1PDE7A
SCHEMBL7786691 0.83 HSD17B10 (0.62) HSD17B10KMT2AALDH1A1VCAM1PDE7A
SCHEMBL868877 0.83 HSD17B10 (0.62) HSD17B10KMT2AALDH1A1VCAM1PDE7A
SCHEMBL3710161 0.81 HSD17B10 (0.60) HSD17B10KMT2AALDH1A1VCAM1PDE7A
SCHEMBL29672035 0.81 HSD17B10 (0.60) HSD17B10KMT2AALDH1A1VCAM1PDE7A
SCHEMBL844111 0.81 HSD17B10 (0.60) HSD17B10KMT2AALDH1A1VCAM1PDE7A
SCHEMBL28978217 0.81 HSD17B10 (0.60) HSD17B10KMT2AALDH1A1VCAM1PDE7A
SCHEMBL8230379 0.81 HSD17B10 (0.60) HSD17B10KMT2AALDH1A1VCAM1PDE7A

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-2003051123-A1 ISOTHIAZOLYLAMINOCARBONYL DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2003-06-26 WO disclosed