SCHEMBL9444066

SCHEMBL9444066

CC(=O)CCc1ccccc1S(=O)(=O)O.[NaH]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ IAPP P10997 2/20 0.49
▸ MYC P01106 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ IKBKB O14920 1/20 0.36
▸ CYP4F2 P78329 1/20 0.35
▸ CYP4A11 Q02928 1/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ MMP2 P08253 3/20 0.33
▸ MMP12 P39900 3/20 0.33
▸ MMP13 P45452 3/20 0.33
▸ MMP14 P50281 3/20 0.33
▸ MMP8 P22894 2/20 0.33
▸ MMP16 P51512 2/20 0.33
▸ MMP1 P03956 2/20 0.33
▸ MMP3 P08254 2/20 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
SCHEMBL9120545 0.98 ALDH1A1 (0.50) ALDH1A1LMNAIAPPMYCTDP1
SCHEMBL10781544 0.83 IAPP (0.53) ALDH1A1LMNAIAPPTDP1
SCHEMBL9120050 0.83 ALDH1A1 (0.49) ALDH1A1LMNAIAPPTDP1SMN1; SMN2
SCHEMBL15303316 0.82 KEAP1 (0.48) ALDH1A1TDP1SMN1; SMN2MAPTMMP2
SCHEMBL9444064 0.81 ALDH1A1 (0.47) ALDH1A1LMNAIAPPTDP1SMN1; SMN2
SCHEMBL4202392 0.81 MYC (0.47) ALDH1A1LMNAMYCTDP1SMN1; SMN2
SCHEMBL30446463 0.81 MYC (0.47) ALDH1A1LMNAMYCTDP1SMN1; SMN2
SCHEMBL27680075 0.80 MYC (0.44) LMNAMYCSMN1; SMN2HPGDCTSB
SCHEMBL16494379 0.80 MMP2 (0.51) ALDH1A1LMNAIAPPMMP2MMP12
SCHEMBL31319091 0.78 MYC (0.46) LMNAMYCSMN1; SMN2HPGDCTSB

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-5220062-A PROCESS FOR THE PREPARATION OF BENEZENESULFONAMIDES CIBA-GEIGY CORPORATION (US) 1993-06-15 — — US disclosed
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