SCHEMBL14989196

SCHEMBL14989196

CC(C)CCCCCCCCc1c(C(=O)O)cc(C(=O)O)c(CCCCCCCCC(C)C)c1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIN2D O15399 1/20 0.39
▸ GRIN2A Q12879 1/20 0.39
▸ GRIN2B Q13224 1/20 0.39
▸ GRIN2C Q14957 1/20 0.39
▸ RARB P10826 3/20 0.36
▸ FUT7 Q11130 1/20 0.35
▸ KAT8 Q9H7Z6 2/20 0.35
▸ PPARA Q07869 2/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ EPAS1 Q99814 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ KDM4C Q9H3R0 2/20 0.33
▸ KDM4A O75164 1/20 0.33
▸ PHF8 Q9UPP1 1/20 0.33
▸ KDM2A Q9Y2K7 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ FABP3 P05413 1/20 0.33
▸ FABP4 P15090 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ LTB4R Q15722 2/20 0.32

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
SCHEMBL14989297 1.00 GRIN2D (0.39) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL14989257 1.00 GRIN2D (0.39) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL14989284 1.00 GRIN2D (0.39) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL14989324 1.00 GRIN2D (0.39) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL31664301 0.91 GRIN2D (0.36) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL14989315 0.91 GRIN2D (0.38) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL14989306 0.91 GRIN2D (0.38) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL14989193 0.91 GRIN2D (0.38) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL14989329 0.91 GRIN2D (0.38) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL14989066 0.91 GRIN2D (0.38) GRIN2DGRIN2AGRIN2BGRIN2CRARB

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
EP-1567470-B1 HYDROGENATION OF BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF EXXONMOBIL CHEM PATENTS INC (US) 2013-06-05 — — EP claimed
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