SCHEMBL9560744

SCHEMBL9560744

CCN(CC)C(=O)n1cnc(S(=O)(=O)n2nc(C3CCCCC3)cc2C)n1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.37
PSMB8 P28062 1/20 0.34
PSMB9 P28065 1/20 0.34
PSMB5 P28074 1/20 0.34
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
ABL1 P00519 1/20 0.31
PROKR1 Q8TCW9 1/20 0.31
KMO O15229 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
SCHEMBL11559102 0.74 ALDH1A1 (0.41) DPP4KDM4EALDH1A1KMT2A
SCHEMBL9549687 0.74 TSHR (0.40) ALDH1A1KMT2A
SCHEMBL9320901 0.74 DPP4 (0.41) DPP4ALDH1A1KMT2A
SCHEMBL9320225 0.74 DPP4 (0.41) DPP4ALDH1A1KMT2A
SCHEMBL11566923 0.73 KMT2A (0.42) DPP4KDM4EALDH1A1KMT2A
SCHEMBL11561421 0.73 DPP4 (0.41) DPP4KDM4EALDH1A1KMT2A
SCHEMBL9320879 0.72 DPP4 (0.42) DPP4KDM4EALDH1A1KMT2A
SCHEMBL9596684 0.70 DPP4 (0.34) DPP4KDM4EALDH1A1KMT2A
SCHEMBL9542985 0.70 DPP4 (0.42) DPP4KDM4EALDH1A1KMT2A
SCHEMBL9320192 0.70 DPP4 (0.42) DPP4KDM4EALDH1A1KMT2A

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
JP-5255316-A None JP disclosed
JP-H05255316-A TRIAZOLE DERIVATIVE AND HERBICIDE HOKKO CHEM IND CO LTD 1993-10-05 JP disclosed