SCHEMBL11520558

SCHEMBL11520558

CC(C)(C)CC(C)(C)S(=O)(=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.45
HSD11B1 P28845 1/20 0.43
HTR6 P50406 2/20 0.41
HTR7 P34969 3/20 0.40
HTR1A P08908 2/20 0.40
DRD2 P14416 2/20 0.40
HTR2A P28223 2/20 0.40
HTR1B P28222 1/20 0.40
ALDH1A1 P00352 6/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CYP2C19 P33261 1/20 0.39
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA3 P07451 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38

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
SCHEMBL25062241 0.86 PSIP1 (0.43) PSIP1HSD11B1HTR6HTR7HTR1A
SCHEMBL7296391 0.81 PSIP1 (0.46) PSIP1HSD11B1HTR6HTR7HTR1A
SCHEMBL13703524 0.81 PSIP1 (0.52) PSIP1HSD11B1HTR6HTR7HTR1A
SCHEMBL6609879 0.79 HTR6 (0.46) PSIP1HSD11B1HTR6HTR7HTR1A
SCHEMBL777161 0.79 PSIP1 (0.45) PSIP1HSD11B1HTR6HTR7HTR1A
SCHEMBL18852692 0.78 PSIP1 (0.48) PSIP1HSD11B1HTR6HTR7HTR1A
SCHEMBL6095322 0.76 HSD11B1 (0.44) PSIP1HSD11B1HTR6HTR7HTR1A
SCHEMBL27645438 0.76 HTR7 (0.44) PSIP1HSD11B1HTR6HTR7HTR1A
SCHEMBL384939 0.75 HTR6 (0.50) PSIP1HSD11B1HTR6ALDH1A1SMN1; SMN2
SCHEMBL6544675 0.75 HTR6 (0.50) PSIP1HSD11B1HTR6ALDH1A1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

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