SCHEMBL3367784

SCHEMBL3367784

NNC(=O)C(=Cc1ccccc1O)N(c1cccc(Br)c1)S(=O)(=O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.37
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
OXTR P30559 2/20 0.35
KMT2A Q03164 2/20 0.34
BRD4 O60885 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
AR P10275 1/20 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
SCHEMBL3399458 0.82 OXTR (0.50) SMN1; SMN2EGFRERBB2OXTRKMT2A
SCHEMBL5643243 0.80 ALDH1A1 (0.43) SMN1; SMN2KMT2AKDM4EMAPTMAPK1
SCHEMBL3367790 0.78 HDAC1 (0.41) SMN1; SMN2EGFRERBB2KMT2ABRD4
SCHEMBL3366543 0.70 TP53 (0.48) SMN1; SMN2OXTRKMT2AMAPTRAB9A
SCHEMBL3367779 0.69 OXTR (0.71) OXTRKMT2AATMKDM4EMAPT
SCHEMBL3364023 0.68 TRPM5 (0.44) SMN1; SMN2KMT2AKDM4EMAPTMAPK1
SCHEMBL1860344 0.66 KMT2A (0.49) SMN1; SMN2EGFRERBB2KMT2ABRD4
SCHEMBL21647723 0.66 SMN1; SMN2 (0.46) SMN1; SMN2EGFRERBB2KMT2ABRD4
SCHEMBL3364719 0.65 OXTR (0.52) OXTRKMT2AKDM4EMAPTL3MBTL1
SCHEMBL3364725 0.65 OXTR (0.52) OXTRKMT2AKDM4EMAPTL3MBTL1

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