SCHEMBL12658602

SCHEMBL12658602

CCC(=O)O[C@H]1CC[C@H](C(=O)O)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.42
PLAT P00750 1/20 0.42
LMNA P02545 1/20 0.42
NAAA Q02083 2/20 0.42
CHRM2 P08172 2/20 0.38
CHRM4 P08173 2/20 0.38
CHRM1 P11229 2/20 0.38
CHRM3 P20309 2/20 0.38
CYP19A1 P11511 3/20 0.37
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
TSHR P16473 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 1/20 0.37
GABRB2 P47870 1/20 0.37

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
SCHEMBL10944117 1.00 PLG (0.42) PLGPLATLMNANAAACHRM2
SCHEMBL12658589 1.00 PLG (0.42) PLGPLATLMNANAAACHRM2
SCHEMBL21765657 0.89 NAAA (0.48) NAAACHRM2CHRM4CHRM1CHRM3
SCHEMBL2253713 0.89
SCHEMBL28037534 0.87
Hydrochloric Acid SCHEMBL22466294 0.87
SCHEMBL15305183 0.83 CHRM2 (0.38) PLGPLATLMNANAAACHRM2
SCHEMBL15305195 0.83 CHRM2 (0.38) PLGPLATLMNANAAACHRM2
SCHEMBL11671947 0.82 NAAA (0.68) LMNANAAASMN1; SMN2
SCHEMBL11408733 0.82 NAAA (0.46) PLGPLATLMNANAAACYP19A1

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-2044101-B1 AMINOTHIAZOLE DERIVATIVES AND THEIR USES AS ANTIBACTERIAL AGENTS NOVARTIS AG (CH) 2013-10-09 EP disclosed
EP-2322536-A2 Aminothiazole derivatives and their uses as antibacterial agents Novartis AG (CH) 2011-05-18 EP disclosed