SCHEMBL11334530

SCHEMBL11334530

O=S(O)c1cc(Cl)ccc1Cl.[KH]

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.43
ALDH1A1 P00352 4/20 0.43
HSD17B10 Q99714 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
CYP3A4 P08684 2/20 0.43
TP53 P04637 3/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CASP1 P29466 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 1/20 0.37
MAPK1 P28482 1/20 0.34
HIF1A Q16665 1/20 0.34
ERCC5 P28715 1/20 0.34
FEN1 P39748 1/20 0.34
CCR2 P41597 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL472586 0.98 TSHR (0.44) TSHRALDH1A1HSD17B10TDP1CYP3A4
SCHEMBL30807815 0.98 TSHR (0.44) TSHRALDH1A1HSD17B10TDP1CYP3A4
SCHEMBL11422863 0.90 TSHR (0.39) TSHRALDH1A1HSD17B10TDP1CYP3A4
SCHEMBL10497156 0.80 TSHR (0.44) TSHRALDH1A1HSD17B10TDP1CYP3A4
SCHEMBL11330429 0.79 CYP3A4 (0.42) TSHRALDH1A1CYP3A4TP53MEN1
SCHEMBL19191408 0.78 KMT2A (0.36) TSHRALDH1A1HSD17B10TDP1CYP3A4
SCHEMBL10663959 0.78 TSHR (0.43) TSHRALDH1A1HSD17B10TDP1CYP3A4
SCHEMBL14179811 0.77 ALDH1A1 (0.42) ALDH1A1MEN1KMT2ACASP1POLB
SCHEMBL15629572 0.77 CYP3A4 (0.48) TSHRALDH1A1HSD17B10TDP1CYP3A4
SCHEMBL15305842 0.76 ALDH1A1 (0.53) ALDH1A1HSD17B10CYP3A4TP53MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4260552-A INSECTICIDES, HERBICIDES UNIROYAL, INC. (US) 1981-04-07 US disclosed
US-4160846-A Method for controlling insects with tetrasubstituted organotin compounds UNIROYAL, INC. (US) 1979-07-10 US disclosed