SCHEMBL28156742

SCHEMBL28156742

O=C(Nc1ccc(S(=O)(=O)c2ccc(F)cc2)s1)c1ccccc1F

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.52
▸ KAT6A Q92794 2/20 0.52
▸ CRHBP P24387 1/20 0.52
▸ CRHR2 Q13324 1/20 0.52
▸ RXFP1 Q9HBX9 2/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ HPGD P15428 1/20 0.44
▸ CFTR P13569 3/20 0.43
▸ POLB P06746 1/20 0.43
▸ MAPT P10636 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ RORC P51449 1/20 0.42
▸ MDM2 Q00987 1/20 0.42
▸ TP53 P04637 1/20 0.42

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 0.92 HPGD (0.52) LMNAKAT6ACRHBPCRHR2RXFP1
SCHEMBL28846258 0.87 KAT6A (0.55) LMNAKAT6ACRHBPCRHR2MEN1
SCHEMBL28156718 0.85 KAT6A (0.50) LMNAKAT6ACRHBPCRHR2RXFP1
SCHEMBL28156717 0.82 MEN1 (0.50) LMNARXFP1MEN1KMT2ATDP1
SCHEMBL16246393 0.80 CFTR (0.66) LMNAKAT6ACRHBPCRHR2RXFP1
SCHEMBL28157274 0.80 KAT6A (0.57) LMNAKAT6ARXFP1MEN1KMT2A
SCHEMBL28156748 0.80 LMNA (0.41) LMNAKAT6ACRHBPCRHR2RXFP1
SCHEMBL28157305 0.80 MEN1 (0.48) LMNARXFP1MEN1KMT2ATDP1
SCHEMBL28846263 0.79 SMN1; SMN2 (0.42) LMNAKAT6ACRHBPCRHR2RXFP1
SCHEMBL28846257 0.79 MEN1 (0.47) LMNAKAT6ARXFP1MEN1KMT2A

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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