SCHEMBL27552955

SCHEMBL27552955

[CH2]CC1CCCC1c1ccc(C[SH](=O)=O)c(Cl)c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 4/20 0.30
▸ SLC6A2 P23975 3/20 0.30
▸ SLC6A3 Q01959 2/20 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
SCHEMBL27466733 0.78 HDAC8 (0.38) SLC6A4SLC6A3
SCHEMBL27482760 0.77 HPGD (0.33) SLC6A4SLC6A2SLC6A3
SCHEMBL27466234 0.74 GCK (0.33) SLC6A4SLC6A2SLC6A3
SCHEMBL27481680 0.74 HRH3 (0.35) —
SCHEMBL27484543 0.73 SLC6A4 (0.31) SLC6A4SLC6A2SLC6A3
SCHEMBL27483145 0.72 HTR2A (0.44) SLC6A3
SCHEMBL27582670 0.70 MRGPRX4 (0.33) SLC6A4SLC6A2SLC6A3
SCHEMBL27467636 0.66 HDAC8 (0.36) SLC6A4SLC6A2SLC6A3
SCHEMBL27643867 0.65 IDO1 (0.32) —
SCHEMBL19749365 0.62 SLC6A2 (0.46) SLC6A4SLC6A2SLC6A3

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
CN-1151140-C Glucokinase activators - 2004-05-26 — — CN disclosed
CN-1349519-A Glucokinase activators HOFFMANN LA ROCHE (CH) 2002-05-15 — — CN disclosed
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