SCHEMBL10590003

SCHEMBL10590003

Cc1ncc(Cc2nccs2)c(N)n1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TKT P29401 4/20 0.49
LMNA P02545 1/20 0.49
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.44
HSP90AA1 P07900 1/20 0.41

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
SCHEMBL10686150 0.71 LMNA (0.59) TKTLMNAKDM4EALDH1A1
SCHEMBL23748348 0.70 LMNA (0.63) TKTLMNAKDM4EALDH1A1HSP90AA1
SCHEMBL12346332 0.70 LMNA (0.63) TKTLMNAKDM4EALDH1A1
SCHEMBL29895545 0.70 LMNA (0.63) TKTLMNAKDM4EALDH1A1HSP90AA1
SCHEMBL478879 0.70 LMNA (0.63) TKTLMNAKDM4EALDH1A1HSP90AA1
SCHEMBL15369436 0.69 LMNA (0.58) TKTLMNAKDM4EALDH1A1
SCHEMBL16470251 0.69 BACE1 (0.39) TKTALDH1A1
SCHEMBL28044147 0.69 TKT (0.49) TKTLMNAHSP90AA1
SCHEMBL27970697 0.69 TKT (0.49) TKTLMNAKDM4EALDH1A1HSP90AA1
SCHEMBL3787961 0.69 FDPS (0.47) ALDH1A1

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-0329184-A2 Antimers and antimeric conjugation NEORX CORPORATION (US) 1989-08-23 EP disclosed