SCHEMBL7681305

SCHEMBL7681305

CC(C)S(=O)(=O)c1cnc(Cl)c(Cl)c1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 15/20 0.58
NPSR1 Q6W5P4 4/20 0.58
MAPT P10636 2/20 0.50
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
JAK2 O60674 1/20 0.40
PKM P14618 1/20 0.40
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
MITF O75030 1/20 0.37
GAA P10253 1/20 0.36
HTT P42858 1/20 0.36
PTGDR2 Q9Y5Y4 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
SCHEMBL30088403 0.79 ALDH1A1 (0.59) ALDH1A1NPSR1MAPTLMNAPOLB
SCHEMBL3716202 0.79 ALDH1A1 (0.59) ALDH1A1NPSR1MAPTLMNAPOLB
SCHEMBL3998305 0.77 VCAM1 (0.44) ALDH1A1NPSR1SMN1; SMN2
SCHEMBL958949 0.76 ALDH1A1 (0.56) ALDH1A1NPSR1MAPTLMNAPOLB
SCHEMBL31018073 0.76 ALDH1A1 (0.56) ALDH1A1NPSR1MAPTLMNAPOLB
SCHEMBL7677072 0.76 ALDH1A1 (0.65) ALDH1A1NPSR1MAPTLMNAPOLB
SCHEMBL1700033 0.75 ALDH1A1 (0.54) ALDH1A1NPSR1MAPTLMNAPOLB
SCHEMBL10296124 0.75 ALDH1A1 (0.54) ALDH1A1NPSR1MAPTLMNAPOLB
SCHEMBL3709323 0.74 ALDH1A1 (0.68) ALDH1A1NPSR1MAPTLMNAPOLB
Hydrochloric Acid SCHEMBL27833622 0.73 ALDH1A1 (0.53) ALDH1A1NPSR1MAPTLMNAPOLB

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-6448205-B1 FOR THE DESICCATION AND/OR DEFOLIATION OF PLANTS BASF AKTIENGESELLSCHAFT (DE) 2002-09-10 US disclosed