SCHEMBL9626308

SCHEMBL9626308

O=C(CS)NCCNc1cccc2c(S(=O)(=O)O)cccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.44
▸ CA4 P22748 1/20 0.44
▸ CA7 P43166 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ CA14 Q9ULX7 1/20 0.44
▸ TTR P02766 1/20 0.41
▸ HDAC6 Q9UBN7 8/20 0.41
▸ HDAC2 Q92769 5/20 0.41
▸ CYP1A2 P05177 2/20 0.39
▸ PRKAG1 P54619 1/20 0.38
▸ PRKAA1 Q13131 1/20 0.38
▸ PRKAB1 Q9Y478 1/20 0.38
▸ HDAC1 Q13547 7/20 0.37
▸ HDAC8 Q9BY41 5/20 0.37
▸ HDAC3 O15379 4/20 0.37
▸ HDAC4 P56524 4/20 0.37
▸ HDAC7 Q8WUI4 4/20 0.37
▸ HDAC10 Q969S8 4/20 0.37
▸ HDAC11 Q96DB2 4/20 0.37
▸ HDAC9 Q9UKV0 4/20 0.37

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
SCHEMBL21347987 0.87 CA12 (0.47) CA12CA4CA7CA9CA14
SCHEMBL29358898 0.87 CA12 (0.44) CA12CA4CA7CA9CA14
SCHEMBL21347989 0.87 CA12 (0.47) CA12CA4CA7CA9CA14
SCHEMBL25745 0.87 CA12 (0.44) CA12CA4CA7CA9CA14
SCHEMBL29355645 0.87 CA12 (0.44) CA12CA4CA7CA9CA14
SCHEMBL22793508 0.86 TTR (0.43) CA12CA4CA7CA9CA14
SCHEMBL134374 0.85 CA12 (0.47) CA12CA4CA7CA9CA14
SCHEMBL6128009 0.84 CA12 (0.63) CA12CA4CA7CA9CA14
SCHEMBL10478980 0.83 TTR (0.49) CA12CA4CA7CA9CA14
SCHEMBL22793503 0.82 CYP1A2 (0.43) CA12CA4CA7CA9CA14

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0205005-B1 NEW BIOLOGICALLY ACTIVE FLUORESCENT CYCLIC NUCLEOTIDES UNIVERSITA' DEGLI STUDI DI PARMA (IT) 1992-05-13 — — EP claimed
US-4797480-A New biologically active fluorescent cyclic nucleotides UNIVERSITA DEGLI STUDI DI PARMA (IT) 1989-01-10 — — US claimed
EP-0205005-A2 New biologically active fluorescent cyclic nucleotides UNIVERSITA' DEGLI STUDI DI PARMA (IT) 1986-12-17 — — EP claimed
EP-0205005-B1 NEW BIOLOGICALLY ACTIVE FLUORESCENT CYCLIC NUCLEOTIDES UNIVERSITA' DEGLI STUDI DI PARMA (IT) 1992-05-13 — — EP disclosed
US-4797480-A New biologically active fluorescent cyclic nucleotides UNIVERSITA DEGLI STUDI DI PARMA (IT) 1989-01-10 — — US disclosed
EP-0205005-A2 New biologically active fluorescent cyclic nucleotides UNIVERSITA' DEGLI STUDI DI PARMA (IT) 1986-12-17 — — EP disclosed
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