SCHEMBL2740954

SCHEMBL2740954

O=[N+]([O-])c1ccc(NNCc2csc3ccc(Cl)cc23)c(S(=O)(=O)Nc2ccccc2Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRHBP P24387 1/20 0.45
▸ CRHR2 Q13324 1/20 0.45
▸ NHERF1 O14745 1/20 0.43
▸ CA2 P00918 1/20 0.42
▸ MCL1 Q07820 2/20 0.41
▸ GAB1 Q13480 1/20 0.41
▸ PKM P14618 2/20 0.40
▸ FSCN1 Q16658 1/20 0.40
▸ MEN1 O00255 5/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ HTT P42858 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ PSMD14 O00487 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ MAPT P10636 5/20 0.39
▸ GAA P10253 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 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
SCHEMBL13128916 0.81 CA2 (0.47) CA2GAB1PKMMEN1KMT2A
SCHEMBL2740946 0.77 CRHBP (0.59) CRHBPCRHR2NHERF1MCL1PKM
SCHEMBL2740959 0.77 CRHBP (0.51) CRHBPCRHR2NHERF1MCL1PKM
SCHEMBL2740961 0.77 MEN1 (0.51) CRHBPCRHR2NHERF1MCL1PKM
SCHEMBL2740945 0.74 CRHBP (0.51) CRHBPCRHR2NHERF1MCL1PKM
SCHEMBL2740960 0.72 CRHBP (0.46) CRHBPCRHR2NHERF1MCL1PKM
SCHEMBL2740998 0.72 CRHBP (0.60) CRHBPCRHR2NHERF1MCL1PKM
SCHEMBL2740966 0.71 CRHBP (0.57) CRHBPCRHR2NHERF1MCL1PKM
SCHEMBL2740971 0.70 CRHBP (0.49) CRHBPCRHR2NHERF1MCL1MEN1
SCHEMBL15647549 0.69 NFKBIA (0.61) CRHBPCRHR2NHERF1MCL1MEN1

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
US-8088772-B2 Sulfonamides and their use as a medicament THE GENETICS COMPANY, INC. (CH) 2012-01-03 — — US disclosed
US-8088772-B2 Sulfonamides and their use as a medicament THE GENETICS COMPANY, INC. (CH) 2012-01-03 — — US disclosed
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