SCHEMBL1932636

SCHEMBL1932636

C=CCC(=O)O[C@@H]1CCCC[C@H]1c1ccccc1.O[C@@H]1CCCC[C@H]1c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FABP5 Q01469 6/20 0.48
▸ FABP7 O15540 4/20 0.48
▸ FABP3 P05413 3/20 0.48
▸ SLC18A3 Q16572 6/20 0.38
▸ TACR1 P25103 1/20 0.36
▸ HTT P42858 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ KCNQ3 O43525 1/20 0.34
▸ KCNQ2 O43526 1/20 0.34
▸ HPGD P15428 1/20 0.33
▸ SIGMAR1 Q99720 1/20 0.33

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
SCHEMBL15083015 0.94 FABP5 (0.53) FABP5FABP7FABP3SLC18A3TACR1
SCHEMBL1932369 0.94 FABP5 (0.53) FABP5FABP7FABP3SLC18A3TACR1
SCHEMBL15064397 0.94 FABP5 (0.53) FABP5FABP7FABP3SLC18A3TACR1
SCHEMBL12556037 0.94 FABP5 (0.53) FABP5FABP7FABP3SLC18A3TACR1
SCHEMBL6858142 0.77 FABP5 (0.58) FABP5FABP7FABP3SLC18A3TACR1
SCHEMBL9370830 0.77 FABP5 (0.58) FABP5FABP7FABP3SLC18A3TACR1
SCHEMBL28635740 0.76 FABP5 (0.57) FABP5FABP7FABP3SLC18A3TACR1
SCHEMBL28635739 0.76 FABP5 (0.57) FABP5FABP7FABP3SLC18A3TACR1
SCHEMBL7433049 0.76 FABP5 (0.57) FABP5FABP7FABP3SLC18A3TACR1
SCHEMBL28644515 0.76 FABP5 (0.57) FABP5FABP7FABP3SLC18A3TACR1

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-2011066482-A2 CHIRAL SYNTHESIS OF ISOXAZOLINES, ISOXAZOLINE COMPOUNDS, AND USES THEREOF CYTOKINE PHARMASCIENCES, INC. (US) 2011-06-03 — — WO disclosed
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