SCHEMBL9814733

SCHEMBL9814733

CCN(OC)[C@H](C(=O)OP(=O)(O)O)C(C)C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 4/20 0.31
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 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
SCHEMBL9814714 0.87
SCHEMBL9814743 0.76 MMP1 (0.35) MMP1MMP2MMP3
SCHEMBL9814847 0.75 FDPS (0.32)
SCHEMBL9814825 0.75 MMP1 (0.30) MMP1MMP2MMP3
SCHEMBL9814762 0.74 GGPS1 (0.35) ENPP2
SCHEMBL9814698 0.70 MMP1 (0.30) MMP1MMP2MMP3
SCHEMBL27738052 0.66 MMP1 (0.38) ENPP2MMP1MMP2MMP3
SCHEMBL9814756 0.66 ANPEP (0.33)
SCHEMBL12245479 0.65 CA4 (0.43) MMP1MMP2
SCHEMBL9814746 0.64

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
EP-0445201-A1 NUCLEOSIDE ANALOGUES MEDICAL RESEARCH COUNCIL (GB) 1991-09-11 EP disclosed
WO-1990005736-A2 NUCLEOSIDE ANALOGUES MEDICAL RESEARCH COUNCIL (GB) 1990-05-31 WO disclosed