SCHEMBL28993268

SCHEMBL28993268

COc1ccc2c(S(=O)(=O)Nc3cc(F)c(Cl)cc3F)c[nH]c2n1.N#Cc1ccc2c(S(=O)(=O)Nc3cc(F)c(OC(F)F)cc3F)c[nH]c2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 3/20 0.35
▸ ATIC P31939 1/20 0.34
▸ CDK7 P50613 1/20 0.33
▸ CCNH P51946 1/20 0.33
▸ MNAT1 P51948 1/20 0.33
▸ NR3C1 P04150 2/20 0.33
▸ PGR P06401 1/20 0.33
▸ NR3C2 P08235 1/20 0.33
▸ GPR6 P46095 3/20 0.32
▸ SCN9A Q15858 2/20 0.32
▸ SCN1A P35498 1/20 0.32
▸ SCN5A Q14524 1/20 0.32
▸ SCN8A Q9UQD0 1/20 0.32
▸ SLC22A12 Q96S37 3/20 0.32
▸ PIK3R1 P27986 1/20 0.31
▸ PIK3CA P42336 1/20 0.31
▸ GUSB P08236 1/20 0.31
▸ PTGES2 Q9H7Z7 1/20 0.31
▸ BRD1 O95696 1/20 0.30
▸ BRPF1 P55201 1/20 0.30

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
SCHEMBL20339035 0.85 ATIC (0.42) ACLYATICCDK7CCNHMNAT1
SCHEMBL30286677 0.82 MEN1 (0.40) ACLYPIK3CAPTGES2
SCHEMBL20339149 0.82 MEN1 (0.40) ACLYPIK3CAPTGES2
SCHEMBL30286541 0.81 ACLY (0.43) ACLYATICNR3C1PGRNR3C2
SCHEMBL20354880 0.81 ACLY (0.43) ACLYATICNR3C1PGRNR3C2
SCHEMBL23610278 0.78 NR3C1 (0.37) ACLYATICCDK7CCNHMNAT1
SCHEMBL29830218 0.78 NR3C1 (0.37) ACLYATICCDK7CCNHMNAT1
SCHEMBL30286475 0.77 ACLY (0.35) ACLYATICSCN9ASCN1ASCN5A
SCHEMBL20340286 0.77 ACLY (0.35) ACLYATICSCN9ASCN1ASCN5A
SCHEMBL30286621 0.76 CCR2 (0.40) ACLYSCN9ASLC22A12

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
CN-116283712-A (aza) indole-, benzothiophene-and benzofuran-3-sulfonamides 优时比制药有限公司 2023-06-23 — — CN disclosed
CN-116036078-A (aza) indole-, benzothiophene-and benzofuran-3-sulfonamides 优时比制药有限公司 2023-05-02 — — CN disclosed
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