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SCHEMBL14944723

SCHEMBL14944723

O=COC1CC(C(=O)O)C(C(=O)O)CC1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GABRR1 P24046 5/20 0.36
▸ SLC1A2 P43004 2/20 0.32
▸ SLC1A1 P43005 2/20 0.32
▸ GABRR2 P28476 1/20 0.31
▸ KMO O15229 2/20 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
SCHEMBL12364331 0.93 GABRR1 (0.37) GABRR1SLC1A2SLC1A1GABRR2
SCHEMBL14944771 0.93 GABRR1 (0.40) GABRR1SLC1A2SLC1A1GABRR2
SCHEMBL16522351 0.81 GABRR1 (0.34) GABRR1SLC1A2SLC1A1GABRR2
SCHEMBL16351598 0.81 GABRR1 (0.34) GABRR1SLC1A2SLC1A1GABRR2
SCHEMBL12221572 0.78 GABRR1 (0.32) GABRR1
SCHEMBL12221569 0.78 GABRR1 (0.32) GABRR1
SCHEMBL28833953 0.76 — —
SCHEMBL16351591 0.75 HSD11B1 (0.37) GABRR1SLC1A2GABRR2
SCHEMBL16351599 0.75 SLC1A2 (0.33) GABRR1SLC1A2SLC1A1
SCHEMBL25280526 0.73 GABRR1 (0.39) GABRR1SLC1A2SLC1A1GABRR2KMO

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-9217109-B2 Polymer-stabilised liquid-crystal media and displays MERCK PATENT GMBH (DE) 2015-12-22 — — US disclosed
US-20130119311-A1 POLYMER-STABILISED LIQUID-CRYSTAL MEDIA AND DISPLAYS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-05-16 — — US disclosed
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