SCHEMBL27465660

SCHEMBL27465660

CCC(=O)OC(c1ccc(C[SH](=O)=O)c(Cl)c1)C1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 7/20 0.40
▸ LMNA P02545 1/20 0.36
▸ SLC6A2 P23975 5/20 0.35
▸ SLC6A4 P31645 5/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ TAS1R3 Q7RTX0 1/20 0.33
▸ TAS1R1 Q7RTX1 1/20 0.33
▸ METAP2 P50579 2/20 0.32

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
SCHEMBL27467640 0.87 PTGS1 (0.35) SLC6A3LMNA
SCHEMBL27465661 0.79 KCNH2 (0.43) SLC6A3LMNASLC6A2SLC6A4ALOX5
SCHEMBL27523626 0.76 KMT2A (0.45) SLC6A3LMNA
SCHEMBL27515306 0.74 FFAR1 (0.45) SLC6A3SLC6A2SLC6A4METAP2
SCHEMBL27552958 0.74 SLC6A3 (0.38) SLC6A3SLC6A2SLC6A4METAP2
SCHEMBL27482051 0.71 SLC6A3 (0.37) SLC6A3SLC6A2SLC6A4
SCHEMBL27466230 0.70 APP (0.42) SLC6A3SLC6A2SLC6A4METAP2
SCHEMBL27467641 0.70 ALDH1A1 (0.32) SLC6A3LMNA
SCHEMBL27466733 0.67 HDAC8 (0.38) SLC6A3SLC6A4
SCHEMBL21985594 0.62 LMNA (0.39) SLC6A3LMNA

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
Send feedback