SCHEMBL30897033

SCHEMBL30897033

Cc1cn([C@H]2C[C@H](I)[C@@H](OCP(=O)(O)O)O2)c(=O)[nH]c1=O

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TK1 P04183 9/20 0.60
POLB P06746 1/20 0.51
NT5M Q9NPB1 1/20 0.49
ALB P02768 1/20 0.48
PKM P14618 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
SCHEMBL12150186 0.91 TK1 (0.57) TK1POLB
SCHEMBL8711789 0.88 TK1 (0.78) TK1POLB
SCHEMBL12154745 0.88 TK1 (0.61) TK1POLB
SCHEMBL30897101 0.87 TK1 (0.44) TK1
SCHEMBL8711268 0.87 TK1 (0.76) TK1POLB
SCHEMBL29761439 0.83 TK1 (0.67) TK1POLBALBPKM
SCHEMBL12150125 0.80 TK1 (0.76) TK1POLB
SCHEMBL12150194 0.80 TK1 (0.76) TK1POLB
SCHEMBL25145531 0.80 TK1 (0.57) TK1POLBALBPKM
SCHEMBL291317 0.79 TK1 (0.55) TK1POLB

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-2024107859-A1 CYCLOPENTENE-OXYMETHYLENE PHOSPHONAMIDATES AND RELATED COMPOUNDS AND THEIR USE IN TREATING MEDICAL CONDITIONS ROME THERAPEUTICS, INC. (US) 2024-05-23 WO disclosed