SCHEMBL3367790

SCHEMBL3367790

O=C(NNO)C(=Cc1ccccc1)N(c1cccc(Br)c1)S(=O)(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.41
HDAC8 Q9BY41 2/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
EGFR P00533 1/20 0.38
ERBB2 P04626 1/20 0.38
MAOB P27338 3/20 0.37
MAOA P21397 2/20 0.37
KMT2A Q03164 1/20 0.36
PTGS2 P35354 1/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36

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
SCHEMBL3399462 0.81 KMT2A (0.45) HDAC1HDAC8SMN1; SMN2EGFRERBB2
SCHEMBL3367784 0.78 SMN1; SMN2 (0.37) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL5643243 0.76 ALDH1A1 (0.43) SMN1; SMN2KMT2AAKR1C3AKR1C2LMNA
SCHEMBL3366546 0.70 TP53 (0.49) SMN1; SMN2KMT2A
SCHEMBL1860344 0.69 KMT2A (0.49) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL21647723 0.68 SMN1; SMN2 (0.46) SMN1; SMN2EGFRERBB2KMT2ABRD4
SCHEMBL21647692 0.66 SMN1; SMN2 (0.60) SMN1; SMN2KMT2ALMNAHTTMTNR1A
SCHEMBL3367782 0.65 SMN1; SMN2 (0.51) SMN1; SMN2LMNAHTT
SCHEMBL23706376 0.63 SMN1; SMN2 (0.41) SMN1; SMN2EGFRERBB2MAOBMAOA
SCHEMBL7988653 0.62 MAOB (0.41) HDAC1HDAC8HDAC3HDAC4HDAC7

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-1335901-B1 PHARMACEUTICALLY ACTIVE SULFANILIDE DERIVATIVES MERCK SERONO SA (CH) 2010-04-14 EP disclosed
US-7312358-B2 Pharmaceutically active sulfanilide derivatives LABORATOIRES SERONO SA (CH) 2007-12-25 US disclosed