SCHEMBL14465121

SCHEMBL14465121

CC(CC(=O)O)C1(C)C[C@@H]1CCC(=O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GABRP O00591 2/20 0.31
GABRD O14764 2/20 0.31
GABRA1 P14867 2/20 0.31
GABRB1 P18505 2/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
GABRA5 P31644 2/20 0.31
GABRA3 P34903 2/20 0.31
GABRA2 P47869 2/20 0.31
GABRB2 P47870 2/20 0.31
GABRA4 P48169 2/20 0.31
GABRE P78334 2/20 0.31
GABRA6 Q16445 2/20 0.31
GABRG1 Q8N1C3 2/20 0.31
GABRG3 Q99928 2/20 0.31
GABRQ Q9UN88 2/20 0.31
CYP1A2 P05177 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
SCHEMBL2892528 0.73 UGT2B7 (0.39) TSHRUGT2B7
SCHEMBL27620538 0.65 SLC22A6 (0.36) SMN1; SMN2CYP1A2MAPTUGT2B7
SCHEMBL8097536 0.63 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2MAPTCYP3A4TSHR
SCHEMBL22963815 0.62 MME (0.35) ALDH1A1SMN1; SMN2CYP1A2TSHRUGT2B7
SCHEMBL13756314 0.61 SLC22A6 (0.36) ALDH1A1SMN1; SMN2GABRPGABRDGABRA1
SCHEMBL1536541 0.61 LMNA (0.46) ALDH1A1TSHR
SCHEMBL25118413 0.60 GPR84 (0.35) MAPT
SCHEMBL23533413 0.59 TSHR (0.48) ALDH1A1TSHR
SCHEMBL15618969 0.59 APLNR (0.46) MAPTTSHR
Succinic Acid SCHEMBL8366457 0.58 LMNA (0.53) ALDH1A1GABRPGABRDGABRA1GABRB1

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-2007084319-A2 DIARYL PIPERIDINES AS CB1 MODULATORS SCHERING CORPORATION (US) 2007-07-26 WO disclosed