SCHEMBL3366546

SCHEMBL3366546

COc1ccc(S(=O)(=O)N(C(=Cc2ccccc2)C(=O)NNO)c2ccc(Cl)cc2)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.49
MAPT P10636 3/20 0.49
THRB P10828 1/20 0.49
PKM P14618 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
OXTR P30559 2/20 0.41
AVPR1A P37288 1/20 0.41
HCRTR2 O43614 3/20 0.41
HCRTR1 O43613 2/20 0.41
NR2F2 P24468 1/20 0.40
RAB9A P51151 1/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PTGER1 P34995 1/20 0.39
FLT1 P17948 1/20 0.39
FLT4 P35916 1/20 0.39
KDR P35968 1/20 0.39

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 0.85 KMT2A (0.45) TP53MAPTSMN1; SMN2OXTRUSP2
SCHEMBL3366543 0.80 TP53 (0.48) TP53MAPTTHRBPKMSMN1; SMN2
SCHEMBL3364023 0.72 TRPM5 (0.44) TP53MAPTTHRBPKMSMN1; SMN2
SCHEMBL3366540 0.70 TP53 (0.56) TP53MAPTPKMSMN1; SMN2OXTR
SCHEMBL3367790 0.70 HDAC1 (0.41) SMN1; SMN2KMT2A
SCHEMBL18546039 0.68 TP53 (0.69) TP53MAPTTHRBHCRTR2HCRTR1
SCHEMBL5643243 0.67 ALDH1A1 (0.43) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL7418318 0.65 PDE4A (0.69) TP53MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL3366536 0.65 OXTR (0.74) MAPTSMN1; SMN2OXTRAVPR1AHCRTR2
SCHEMBL3369096 0.65 OXTR (0.74) MAPTSMN1; SMN2OXTRAVPR1AHCRTR2

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