SCHEMBL15905910

SCHEMBL15905910

CCCC(O)CC(N)CC(O)CC(O)CC(C)O

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.32
METAP1 P53582 1/20 0.31
TSHR P16473 2/20 0.31
GRIK1 P39086 1/20 0.31
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31
GRIK2 Q13002 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
SCHEMBL122838 0.89 TSHR (0.38) TSHR
SCHEMBL124516 0.89 TSHR (0.38) TSHR
SCHEMBL126139 0.89 TSHR (0.38) TSHR
SCHEMBL110741 0.84
SCHEMBL15031022 0.80 TSHR (0.41) TSHR
SCHEMBL21374119 0.80 ALDH1A1 (0.38) SPHK1METAP1TSHRGRIK1SLC1A3
SCHEMBL7011297 0.80 ALDH1A1 (0.38) SPHK1METAP1TSHRGRIK1SLC1A3
SCHEMBL28374323 0.78 GRIK1 (0.34) SPHK1METAP1GRIK1SLC1A3SLC1A2
SCHEMBL16675541 0.77 TSHR (0.37) TSHR
SCHEMBL16153750 0.76 TSHR (0.38) TSHRGRIK1SLC1A3SLC1A2SLC1A1

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
US-8790632-B2 Polymer-based tissue-adhesive form medical use ACTAMAX SURGICAL MATERIALS, LLC (US) 2014-07-29 US disclosed