SCHEMBL19302874

SCHEMBL19302874

COC(=O)c1cccc(C(=O)CCC(=O)NS(=O)(=O)NC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)c1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HINT1 P49773 1/20 0.55
NNMT P40261 1/20 0.55

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
SCHEMBL19302866 0.92 GNMT (0.60) HINT1
SCHEMBL19302867 0.89 TARS1 (0.64)
SCHEMBL19302678 0.89 HINT1 (0.56) HINT1
SCHEMBL19302868 0.86 NNMT (0.54) NNMT
SCHEMBL19302776 0.84 HINT1 (0.55) HINT1
SCHEMBL19302879 0.84 NNMT (0.54) NNMT
SCHEMBL19302681 0.83 HINT1 (0.58) HINT1
SCHEMBL19302918 0.83 HINT1 (0.56) HINT1
SCHEMBL19302805 0.81
SCHEMBL19303050 0.81

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
WO-2017059411-A9 INHIBITORS OF MENAQUINONE BIOSYNTHESIS MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2017-08-31 WO disclosed