SCHEMBL10778357

SCHEMBL10778357

O=C1SCc2ccccc21.O=S(=O)(Cl)Cl

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 0.81
▸ MAOA P21397 4/20 0.42
▸ CES1 P23141 3/20 0.42
▸ S100A4 P26447 2/20 0.39
▸ BCHE P06276 2/20 0.39
▸ AKR1B1 P15121 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ MAPK14 Q16539 1/20 0.37
▸ KMT2A Q03164 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ CDC25B P30305 1/20 0.36
▸ IDO1 P14902 1/20 0.35
▸ DNMT1 P26358 1/20 0.35
▸ DNMT3L Q9UJW3 1/20 0.35
▸ DNMT3A Q9Y6K1 1/20 0.35
▸ MAOB P27338 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ CES2 O00748 1/20 0.34
▸ APAF1 O14727 1/20 0.34
▸ TERT O14746 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
SCHEMBL5845169 0.90 ACHE (1.00) ACHEMAOACES1S100A4BCHE
SCHEMBL25385438 0.82 ACHE (0.83) ACHEMAOACES1S100A4BCHE
SCHEMBL86279 0.71 ACHE (0.59) ACHEMAOACES1S100A4BCHE
SCHEMBL31510701 0.71 ACHE (0.59) ACHEMAOACES1S100A4BCHE
SCHEMBL31123671 0.71 ACHE (0.59) ACHEMAOACES1S100A4BCHE
SCHEMBL565750 0.70 ACHE (0.53) ACHEMAOACES1S100A4BCHE
SCHEMBL565749 0.70 ACHE (0.53) ACHEMAOACES1S100A4BCHE
SCHEMBL567340 0.70 ACHE (0.53) ACHEMAOACES1S100A4BCHE
Fluorene SCHEMBL4327570 0.70 MAOA (0.65) MAOACES1BCHEALDH1A1KMT2A
SCHEMBL1254053 0.69 ACHE (0.63) ACHEMAOACES1S100A4BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4687508-A Herbicidal benzenesulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-08-18 — — US disclosed
US-4578108-A Herbicidal benzenesulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-03-25 — — US disclosed
US-4521241-A PLANT GROWTH REGULATORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-06-04 — — US disclosed
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