SCHEMBL20117554

SCHEMBL20117554

NSc1cccc(NS(=O)(=O)c2ccc(-c3ccc(Cl)cc3Cl)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.57
GPR27 Q9NS67 2/20 0.47
PTGES2 Q9H7Z7 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
GAA P10253 2/20 0.45
HPGD P15428 1/20 0.45
MEN1 O00255 1/20 0.43
PKM P14618 1/20 0.43
KMT2A Q03164 1/20 0.43
AVPR2 P30518 1/20 0.43
ALOX15 P16050 1/20 0.43
ATIC P31939 1/20 0.43
PGR P06401 2/20 0.42
HTR6 P50406 1/20 0.42
POLB P06746 1/20 0.41
CES1 P23141 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41

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
SCHEMBL2237776 0.83 CA1 (0.60) CYP19A1GPR27PTGES2MEN1KMT2A
SCHEMBL10093407 0.81 ATIC (0.58) CYP19A1GPR27MEN1KMT2AAVPR2
SCHEMBL2237042 0.80 CYP19A1 (0.58) CYP19A1GPR27PTGES2GAAMEN1
SCHEMBL2236105 0.80 CYP19A1 (0.58) CYP19A1GPR27PTGES2MEN1PKM
SCHEMBL2234339 0.79 CYP19A1 (0.57) CYP19A1GPR27MEN1KMT2AAVPR2
SCHEMBL15232983 0.79 CYP19A1 (0.57) CYP19A1GPR27MEN1PKMKMT2A
SCHEMBL2235467 0.79 POLB (0.70) CYP19A1GPR27MEN1KMT2APOLB
SCHEMBL2234325 0.78 CYP19A1 (0.56) CYP19A1GPR27GAAMEN1KMT2A
SCHEMBL13464221 0.78 CYP19A1 (0.56) CYP19A1GPR27PTGES2HPGDMEN1
SCHEMBL2896014 0.78 CYP19A1 (0.56) CYP19A1GPR27AVPR2ALOX15HTR6

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
EP-2349990-B1 ARYL-PHENYL-SULFONAMIDE-PHENYLENE COMPOUNDS AND THEIR USE PIMCO 2664 LTD (GB) 2018-05-02 EP disclosed