SCHEMBL2369748

SCHEMBL2369748

CCCCC(O)([C]=O)CO

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FDPS P14324 10/20 0.34
GGPS1 O95749 7/20 0.34
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
SMPD1 P17405 1/20 0.31

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
SCHEMBL3507321 0.91 FDPS (0.44) FDPSGGPS1SMPD1
SCHEMBL3502980 0.91 FDPS (0.44) FDPSGGPS1SMPD1
SCHEMBL321873 0.91 FDPS (0.44) FDPSGGPS1SMPD1
SCHEMBL3502976 0.91 FDPS (0.44) FDPSGGPS1SMPD1
SCHEMBL10655090 0.91 FDPS (0.44) FDPSGGPS1SMPD1
SCHEMBL1717782 0.86
SCHEMBL6362359 0.82 HRH3 (0.45)
SCHEMBL7787076 0.77
SCHEMBL6554839 0.75
SCHEMBL20656782 0.72 FDPS (0.36) FDPSGGPS1ALDH1A1SMN1; SMN2

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-2011104134-A1 SACCHARIDE DERIVATIVES UNIVERSITY OF PORTSMOUTH HIGHER EDUCATION CORPORATION (GB) 2011-09-01 WO disclosed