SCHEMBL11670581

SCHEMBL11670581

CCCCN(CCCC)S(=O)(=O)c1cc(Cl)c(Cl)c(Cl)c1SCSC#N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ VCAM1 P19320 2/20 0.37
▸ SMN1; SMN2 Q16637 4/20 0.34
▸ POLB P06746 1/20 0.34
▸ MCOLN3 Q8TDD5 1/20 0.31
▸ LMNA P02545 3/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ HTT P42858 2/20 0.31
▸ NPSR1 Q6W5P4 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ P4HB P07237 1/20 0.31
▸ TSHR P16473 4/20 0.31
▸ KMT2A Q03164 3/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ USP2 O75604 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ THRB P10828 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ GLA P06280 1/20 0.30

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
SCHEMBL11672334 0.93 ALDH1A1 (0.37) VCAM1SMN1; SMN2MCOLN3LMNAALDH1A1
SCHEMBL11670279 0.88 SMN1; SMN2 (0.39) VCAM1SMN1; SMN2POLBMCOLN3LMNA
SCHEMBL11510273 0.84 VCAM1 (0.42) VCAM1SMN1; SMN2POLBMCOLN3LMNA
SCHEMBL11670893 0.83 TSHR (0.36) ALDH1A1HTTMAPTTSHRKMT2A
SCHEMBL11508081 0.76 ALDH1A1 (0.43) VCAM1SMN1; SMN2MCOLN3ALDH1A1NPSR1
SCHEMBL11670822 0.72 VCAM1 (0.45) VCAM1SMN1; SMN2POLBMCOLN3LMNA
SCHEMBL11509567 0.71 MCOLN3 (0.44) VCAM1SMN1; SMN2MCOLN3LMNAALDH1A1
SCHEMBL10687962 0.66 ALDH1A1 (0.47) VCAM1SMN1; SMN2POLBMCOLN3LMNA
SCHEMBL11510397 0.65 ALDH1A1 (0.42) VCAM1LMNAALDH1A1MAPTTSHR
SCHEMBL11671776 0.64 ALDH1A1 (0.46) VCAM1SMN1; SMN2MCOLN3ALDH1A1NPSR1

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-4041073-A 3,4,5-Trichloro-N,N-di(loweralkyl)-2-(mercapto) benzenesulfonamides THE DOW CHEMICAL COMPANY (US) 1977-08-09 — — US disclosed
US-4035407-A 3,4,5-Trichloro-N,N-di(loweralkyl)-2-thiomethylthiocyanato)benzene-sulfonamides THE DOW CHEMICAL COMPANY (US) 1977-07-12 — — US disclosed
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