SCHEMBL14167279

SCHEMBL14167279

CCCCC/C=C/CC(CC/C=C/C/C=C/CCCC(=O)O)[N+](=O)[O-]

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NFKB1 P19838 1/20 0.67
▸ NFKB2 Q00653 1/20 0.67
▸ RELA Q04206 1/20 0.67
▸ PPARG P37231 5/20 0.62
▸ ALDH1A1 P00352 5/20 0.62
▸ PPARD Q03181 4/20 0.62
▸ PPARA Q07869 4/20 0.62
▸ L3MBTL1 Q9Y468 2/20 0.62
▸ KDM4E B2RXH2 2/20 0.62
▸ LMNA P02545 2/20 0.62
▸ CYP3A4 P08684 2/20 0.62
▸ CYP19A1 P11511 2/20 0.62
▸ FABP4 P15090 2/20 0.62
▸ HPGD P15428 2/20 0.62
▸ ALOX15 P16050 2/20 0.62
▸ NR4A2 P43354 2/20 0.62
▸ HSD17B10 Q99714 2/20 0.62
▸ TDP1 Q9NUW8 2/20 0.62
▸ AKR1C3 P42330 2/20 0.62
▸ MAPT P10636 2/20 0.62

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
SCHEMBL14166620 0.95 NFKB1 (0.60) NFKB1NFKB2RELAPPARGALDH1A1
SCHEMBL14166621 0.95 NFKB1 (0.60) NFKB1NFKB2RELAPPARGALDH1A1
SCHEMBL13745046 0.93 PPARG (0.62) NFKB1NFKB2RELAPPARGALDH1A1
SCHEMBL14167179 0.92 FFAR1 (0.61) NFKB1NFKB2RELAPPARGALDH1A1
SCHEMBL28640561 0.91 ALDH1A1 (0.63) NFKB1NFKB2RELAPPARGALDH1A1
SCHEMBL28640562 0.91 ALDH1A1 (0.63) NFKB1NFKB2RELAPPARGALDH1A1
SCHEMBL14167111 0.91 ALDH1A1 (0.61) NFKB1NFKB2RELAPPARGALDH1A1
SCHEMBL14166752 0.89 ALDH1A1 (0.63) NFKB1NFKB2RELAPPARGALDH1A1
SCHEMBL14167387 0.89 ALDH1A1 (0.63) NFKB1NFKB2RELAPPARGALDH1A1
SCHEMBL14166754 0.89 ALDH1A1 (0.63) NFKB1NFKB2RELAPPARGALDH1A1

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
EP-2717864-A1 BIOPASSIVATING MEMBRANE STABILIZATION BY MEANS OF NITROCARBOXYLIC ACID-CONTAINING PHOSPHOLIPIDS IN PREPARATIONS AND COATINGS Dietz, Ulrich (DE) 2014-04-16 — — EP disclosed
WO-2012168342-A1 BIOPASSIVATING MEMBRANE STABILIZATION BY MEANS OF NITROCARBOXYLIC ACID-CONTAINING PHOSPHOLIPIDS IN PREPARATIONS AND COATINGS DIETZ ULRICH (DE) 2012-12-13 — — WO disclosed
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