SCHEMBL25873114

SCHEMBL25873114

Cc1nc2cc(S(=O)(=O)c3ccc(Br)cc3)ccc2s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.59
ALDH1A1 P00352 6/20 0.56
SMN1; SMN2 Q16637 4/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
PKM P14618 4/20 0.47
KAT8 Q9H7Z6 1/20 0.46
HSD17B10 Q99714 3/20 0.44
LMNA P02545 5/20 0.44
TP53 P04637 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HPGD P15428 2/20 0.43
MAPT P10636 2/20 0.43
PTGS2 P35354 1/20 0.43
HTT P42858 3/20 0.42
CASP3 P42574 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
ALOX15 P16050 1/20 0.42
MAPK1 P28482 1/20 0.42
GAA P10253 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
SCHEMBL12210618 0.87 POLB (0.61) POLBALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL4940110 0.82 LMNA (0.60) POLBALDH1A1SMN1; SMN2PKMLMNA
SCHEMBL10089746 0.80 LMNA (0.65) POLBALDH1A1SMN1; SMN2PKMHSD17B10
SCHEMBL6141396 0.80 POLB (0.68) POLBALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL30181739 0.79 SMN1; SMN2 (0.57) POLBALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL202298 0.79 SMN1; SMN2 (0.57) POLBALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL14612413 0.78 POLB (0.66) POLBALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL84337 0.78 POLB (0.66) POLBALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL3524765 0.78 POLB (0.66) POLBALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL4942304 0.78 TPSAB1 (0.54) POLBALDH1A1PKMHSD17B10LMNA

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-3395795-B1 MALONONITRILE OXIME ETHER COMPOUND AND USE THEREOF SHENYANG SINOCHEM AGROCHEMICALS R & D CO LTD (CN) 2023-07-19 EP disclosed