SCHEMBL8559328

SCHEMBL8559328

COP(=O)(CCC(C)C=CC(=O)O)OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 2/20 0.38
GABRD O14764 2/20 0.38
GABRA1 P14867 2/20 0.38
GABRB1 P18505 2/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
GABRA5 P31644 2/20 0.38
GABRA3 P34903 2/20 0.38
GABRA2 P47869 2/20 0.38
GABRB2 P47870 2/20 0.38
GABRA4 P48169 2/20 0.38
GABRE P78334 2/20 0.38
GABRA6 Q16445 2/20 0.38
GABRG1 Q8N1C3 2/20 0.38
GABRG3 Q99928 2/20 0.38
GABRQ Q9UN88 2/20 0.38
HCAR2 Q8TDS4 2/20 0.32
UGT2B7 P16662 2/20 0.30
ACHE P22303 1/20 0.30
BACE1 P56817 1/20 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
SCHEMBL22500624 0.71 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL22500622 0.71 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL900317 0.71 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL900319 0.71 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL17021602 0.71 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL3884469 0.71 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL28481207 0.70 GABRP (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9493249 0.70 GABRP (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL28293605 0.69 ALDH1A1 (0.35) UGT2B7
SCHEMBL6570484 0.68 GABRP (0.45) GABRPGABRDGABRA1GABRB1GABRG2

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
US-5739373-A Optically active phosphono analogs of succinates and synthesis thereof MONSANTO COMPANY (US) 1998-04-14 US disclosed
US-5473092-A Synthesis of optically-active phosphono analogs of succinates MONSANTO COMPANY (US) 1995-12-05 US disclosed