SCHEMBL7784153

SCHEMBL7784153

O=C(Nc1ccccc1)c1cccc(S(=O)(=O)O)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.67
ALDH1A1 P00352 2/20 0.67
MEN1 O00255 5/20 0.64
KMT2A Q03164 5/20 0.64
LMNA P02545 4/20 0.64
TSHR P16473 1/20 0.64
MAPT P10636 1/20 0.63
HDAC2 Q92769 2/20 0.61
HDAC8 Q9BY41 2/20 0.61
HDAC6 Q9UBN7 2/20 0.61
HDAC1 Q13547 1/20 0.61
KCNK3 O14649 2/20 0.59
KCNK9 Q9NPC2 2/20 0.59
HPGD P15428 1/20 0.58
MAOA P21397 1/20 0.57
MAOB P27338 1/20 0.57
PTBP1 P26599 1/20 0.57
PRMT1 Q99873 1/20 0.57
SIRT1 Q96EB6 1/20 0.57
PKM P14618 1/20 0.56

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
SCHEMBL14372490 0.90 KCNK3 (0.69) MEN1KMT2AKCNK3KCNK9HPGD
SCHEMBL13601056 0.89 KMT2A (0.69) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL10528203 0.86 PTGS1 (0.62) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL10528190 0.86 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL18387929 0.86 SMN1; SMN2 (0.78) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL15277111 0.86 MEN1 (0.63) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL14161532 0.86 MEN1 (0.71) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL11772427 0.84 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL6245393 0.83 TIMP3 (0.58) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL14389426 0.83 MEN1 (0.60) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA

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
EP-1138669-A1 BENZENESULFONIC ACID DERIVATIVE COMPOUNDS, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2001-10-04 EP claimed
EP-1138669-A1 BENZENESULFONIC ACID DERIVATIVE COMPOUNDS, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2001-10-04 EP disclosed