SCHEMBL14167387

SCHEMBL14167387

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

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.63
▸ F7 P08709 7/20 0.63
▸ F3 P13726 7/20 0.63
▸ PPARG P37231 7/20 0.63
▸ PPARD Q03181 6/20 0.63
▸ PPARA Q07869 6/20 0.63
▸ CYP19A1 P11511 5/20 0.63
▸ FFAR1 O14842 5/20 0.63
▸ PTGS1 P23219 4/20 0.63
▸ MAPT P10636 3/20 0.63
▸ OXER1 Q8TDS5 3/20 0.63
▸ KMT2A Q03164 3/20 0.63
▸ FFAR4 Q5NUL3 3/20 0.63
▸ KDM4E B2RXH2 3/20 0.63
▸ LMNA P02545 3/20 0.63
▸ CYP3A4 P08684 3/20 0.63
▸ HPGD P15428 3/20 0.63
▸ ALOX15 P16050 3/20 0.63
▸ HSD17B10 Q99714 3/20 0.63
▸ TDP1 Q9NUW8 3/20 0.63

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
SCHEMBL14166752 1.00 ALDH1A1 (0.63) ALDH1A1F7F3PPARGPPARD
SCHEMBL14166754 1.00 ALDH1A1 (0.63) ALDH1A1F7F3PPARGPPARD
SCHEMBL14167111 0.95 ALDH1A1 (0.61) ALDH1A1F7F3PPARGPPARD
SCHEMBL14167038 0.90 ALDH1A1 (0.59) ALDH1A1F7F3PPARGPPARD
SCHEMBL14167040 0.90 ALDH1A1 (0.59) ALDH1A1F7F3PPARGPPARD
SCHEMBL14167279 0.89 NFKB1 (0.67) ALDH1A1F7F3PPARGPPARD
SCHEMBL14167179 0.89 FFAR1 (0.61) ALDH1A1F7F3PPARGPPARD
SCHEMBL28640561 0.88 ALDH1A1 (0.63) ALDH1A1F7F3PPARGPPARD
SCHEMBL28640562 0.88 ALDH1A1 (0.63) ALDH1A1F7F3PPARGPPARD
SCHEMBL14166621 0.86 NFKB1 (0.60) ALDH1A1F7F3PPARGPPARD

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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