SCHEMBL23846527

SCHEMBL23846527

COc1ccc(N)cc1S(=O)(=O)Nc1ccc(C2(C)N=N2)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALPL P05186 1/20 0.51
▸ SMN1; SMN2 Q16637 5/20 0.50
▸ LMNA P02545 3/20 0.50
▸ HTT P42858 1/20 0.50
▸ RECQL P46063 1/20 0.50
▸ KMT2A Q03164 3/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ ALOX12 P18054 1/20 0.48
▸ GAA P10253 2/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ POLB P06746 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL23846503 0.83 SMN1; SMN2 (0.71) ALPLSMN1; SMN2LMNAHTTRECQL
SCHEMBL17980891 0.82 MAPT (0.60) ALPLSMN1; SMN2LMNAHTTKMT2A
SCHEMBL25754817 0.82 NPSR1 (0.62) ALPLSMN1; SMN2LMNAHTTKMT2A
SCHEMBL23833758 0.82 RECQL (0.73) ALPLSMN1; SMN2LMNARECQLGAA
SCHEMBL23846500 0.82 LMNA (0.73) ALPLSMN1; SMN2LMNAHTTRECQL
SCHEMBL23847019 0.81 MEN1 (0.61) ALPLSMN1; SMN2LMNAHTTRECQL
SCHEMBL23847027 0.81 MEN1 (0.59) ALPLSMN1; SMN2LMNAHTTRECQL
SCHEMBL23846529 0.80 ALPL (0.60) ALPLSMN1; SMN2LMNAHTTKMT2A
SCHEMBL23833737 0.79 MEN1 (0.63) ALPLSMN1; SMN2LMNAHTTRECQL
SCHEMBL7535714 0.78 SMN1; SMN2 (0.72) ALPLSMN1; SMN2LMNAKMT2AMEN1

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
WO-2021188880-A1 BENZENESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF AMATHUS THERAPEUTICS, INC. (US) 2021-09-23 — — WO disclosed
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