SCHEMBL11548672

SCHEMBL11548672

CC(N)O.CC(OOC(=O)CCC(=O)O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 2/20 0.39
GABRD O14764 2/20 0.39
GABRA1 P14867 2/20 0.39
GABRB1 P18505 2/20 0.39
GABRG2 P18507 2/20 0.39
GABRB3 P28472 2/20 0.39
GABRA5 P31644 2/20 0.39
GABRA3 P34903 2/20 0.39
GABRA2 P47869 2/20 0.39
GABRB2 P47870 2/20 0.39
GABRA4 P48169 2/20 0.39
GABRE P78334 2/20 0.39
GABRA6 Q16445 2/20 0.39
GABRG1 Q8N1C3 2/20 0.39
GABRG3 Q99928 2/20 0.39
GABRQ Q9UN88 2/20 0.39
KDM2A Q9Y2K7 3/20 0.37
EGLN1 Q9GZT9 2/20 0.37
KDM6B O15054 1/20 0.37
KDM5C P41229 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
SCHEMBL8996644 0.93 EGLN1 (0.42) GABRPGABRDGABRA1GABRB1GABRG2
Ammonia Solution, Strong SCHEMBL11412535 0.91 EGLN1 (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8996634 0.87 TSHR (0.36) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL11547070 0.78 GABRP (0.42) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL11543619 0.78 KDM6B (0.32) KDM2AEGLN1KDM6BKDM5CPHF8
SCHEMBL11548421 0.78 KDM6B (0.35) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL10877080 0.77 EGLN1 (0.45) GABRPGABRDGABRA1GABRB1GABRG2
Potassium Ion SCHEMBL11403492 0.76 CA1 (0.38)
SCHEMBL11411203 0.76 CA1 (0.41)
Succinic Acid SCHEMBL1833787 0.76 GABRP (0.62) 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-4137260-A SEEDING WITH TETRAHYDRATE OR PENTAHYDRATE CRYSTALS ETHYL CORPORATION (US) 1979-01-30 US disclosed
US-4100188-A RECOVERING AN ALKALI METAL, AMMONIUM, OR AMINE SALT OF CARBOXYALKOXY SUCCINIC ACIDS ETHYL CORPORATION (US) 1978-07-11 US disclosed