SCHEMBL10313738

SCHEMBL10313738

Cc1ccc(S(=O)(=O)n2cc(C(=O)C(N)=CN(C)C)c3ccccc32)cc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 9/20 0.64
▸ PTGS2 P35354 2/20 0.59
▸ KDM4E B2RXH2 1/20 0.54
▸ UBE2N P61088 1/20 0.54
▸ HTR6 P50406 2/20 0.54
▸ LMNA P02545 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ AKR1C3 P42330 1/20 0.50
▸ AKR1C1 Q04828 1/20 0.50
▸ HDAC1 Q13547 1/20 0.50
▸ HDAC2 Q92769 1/20 0.50
▸ HDAC6 Q9UBN7 1/20 0.50
▸ PLK1 P53350 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ TNF P01375 1/20 0.48

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
SCHEMBL12908488 0.86 ALOX5 (0.58) ALOX5PTGS2KDM4EUBE2NHTR6
SCHEMBL10002868 0.84 ALOX5 (0.58) ALOX5PTGS2KDM4EUBE2NHTR6
SCHEMBL10002866 0.84 ALOX5 (0.58) ALOX5PTGS2KDM4EUBE2NHTR6
SCHEMBL22638205 0.82 ALOX5 (0.65) ALOX5PTGS2KDM4EUBE2NHTR6
SCHEMBL30689046 0.82 ALOX5 (0.65) ALOX5PTGS2KDM4EUBE2NHTR6
SCHEMBL28709439 0.80 HDAC1 (0.69) ALOX5PTGS2KDM4EUBE2NHTR6
SCHEMBL13302218 0.80 ALOX5 (0.68) ALOX5PTGS2KDM4EUBE2NHTR6
SCHEMBL29414776 0.79 AKR1C3 (0.78) ALOX5PTGS2KDM4EUBE2NHTR6
SCHEMBL949348 0.79 LMNA (0.82) ALOX5PTGS2KDM4EUBE2NHTR6
SCHEMBL12748306 0.79 AKR1C3 (0.78) ALOX5PTGS2KDM4EUBE2NHTR6

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
EP-2471786-A1 AMINOPYRAZOLE DERIVATIVE Chugai Seiyaku Kabushiki Kaisha (JP) 2012-07-04 — — EP disclosed
Send feedback