SCHEMBL2309959

SCHEMBL2309959

CNC(CO)c1cccc(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.51
FABP1 P07148 1/20 0.50
UQCRB P14927 2/20 0.48
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
PFKFB3 Q16875 2/20 0.46
HTR6 P50406 3/20 0.45
ALOX12 P18054 1/20 0.44
KDM1A O60341 1/20 0.44
IKBKB O14920 1/20 0.44
GAA P10253 1/20 0.43

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
SCHEMBL10093392 1.00 POLB (0.51) POLBFABP1UQCRBHDAC3HDAC4
SCHEMBL10093369 0.87 HSD17B2 (0.56) UQCRBALOX12IKBKBGAAHPGD
SCHEMBL10093389 0.84 POLB (0.54) POLBFABP1UQCRBHDAC3HDAC4
SCHEMBL2241347 0.84 AVPR2 (0.43) POLBALOX12ALDH1A1
SCHEMBL10093354 0.84 CYP19A1 (0.50) POLBHDAC3HDAC4HDAC1HDAC7
SCHEMBL2309039 0.84 FABP1 (0.49) POLBFABP1UQCRBHDAC3HDAC4
SCHEMBL2235893 0.84 AVPR2 (0.43) POLBALOX12ALDH1A1
SCHEMBL2238392 0.84 AVPR2 (0.43) POLBALOX12ALDH1A1
SCHEMBL10093378 0.82 GPR27 (0.45) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10093381 0.81 CYP19A1 (0.44) KDM1AGAAHPGDMEN1ALDH1A1

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-A1 ARYL-PHENYL-SULFONAMIDE-PHENYLENE COMPOUNDS AND THEIR USE Pimco 2664 Limited (GB) 2011-08-03 EP disclosed