SCHEMBL28846258

SCHEMBL28846258

O=C(Nc1ccc(S(=O)(=O)c2cccc(F)c2)s1)c1ccccc1F

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KAT6A Q92794 10/20 0.55
▸ CRHBP P24387 1/20 0.44
▸ CRHR2 Q13324 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ LMNA P02545 1/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ SLC10A2 Q12908 1/20 0.42
▸ SLC10A1 Q14973 1/20 0.42
▸ SLC10A6 Q3KNW5 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ ABCC9 O60706 1/20 0.40
▸ ABCC8 Q09428 1/20 0.40
▸ KCNJ11 Q14654 1/20 0.40
▸ KCNJ8 Q15842 1/20 0.40

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
SCHEMBL28846379 0.89 HPGD (0.52) KAT6ACRHBPCRHR2HPGDLMNA
SCHEMBL28156742 0.87 LMNA (0.52) KAT6ACRHBPCRHR2HPGDLMNA
SCHEMBL16246226 0.82 CFTR (0.53) KAT6ACRHBPCRHR2HPGDLMNA
SCHEMBL28156718 0.82 KAT6A (0.50) KAT6ACRHBPCRHR2HPGDLMNA
SCHEMBL28156748 0.79 LMNA (0.41) KAT6ACRHBPCRHR2HPGDLMNA
SCHEMBL28156717 0.79 MEN1 (0.50) HPGDLMNAMEN1KMT2ATDP1
SCHEMBL28157361 0.77 CFTR (0.52) LMNASMN1; SMN2ABCC9ABCC8KCNJ11
SCHEMBL28157305 0.77 MEN1 (0.48) HPGDLMNAMEN1KMT2ATDP1
SCHEMBL28846263 0.76 SMN1; SMN2 (0.42) KAT6ACRHBPCRHR2HPGDLMNA
SCHEMBL28846257 0.76 MEN1 (0.47) KAT6AHPGDLMNAMEN1KMT2A

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
CN-105531268-B Noval chemical compound and its pharmaceutical composition for treating cystic fibrosis 加拉佩格斯股份有限公司 2017-09-12 — — CN disclosed
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