SCHEMBL2370886

SCHEMBL2370886

CCCCCCCC/C=C\CCCCCCCCCC(CCCC(=O)O)[N+](=O)[O-]

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 5/20 0.61
▸ PPARA Q07869 5/20 0.61
▸ PPARD Q03181 4/20 0.61
▸ F7 P08709 4/20 0.61
▸ F3 P13726 4/20 0.61
▸ TERT O14746 3/20 0.61
▸ PTPN1 P18031 3/20 0.61
▸ TOP1 P11387 3/20 0.61
▸ HSD17B10 Q99714 3/20 0.61
▸ FABP4 P15090 3/20 0.61
▸ MAPT P10636 2/20 0.61
▸ BLM P54132 2/20 0.61
▸ LMNA P02545 2/20 0.61
▸ ALOX15 P16050 2/20 0.61
▸ DUSP3 P51452 2/20 0.61
▸ CYP19A1 P11511 2/20 0.61
▸ PTGS1 P23219 2/20 0.61
▸ NR4A2 P43354 2/20 0.61
▸ SIRT6 Q8N6T7 2/20 0.61
▸ PTPN7 P35236 2/20 0.61

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
SCHEMBL2370893 1.00 PPARG (0.61) PPARGPPARAPPARDF7F3
SCHEMBL28633230 0.91 PPARG (0.65) PPARGPPARAPPARDF7F3
SCHEMBL28633229 0.91 PPARG (0.65) PPARGPPARAPPARDF7F3
SCHEMBL28182212 0.91 FFAR1 (0.65) PPARGPPARAPPARDF7F3
SCHEMBL31542094 0.91 FFAR1 (0.65) PPARGPPARAPPARDF7F3
SCHEMBL31542088 0.91 FFAR1 (0.65) PPARGPPARAPPARDF7F3
SCHEMBL28957396 0.89 PPARG (0.64) PPARGPPARAPPARDF7F3
SCHEMBL14166943 0.89 ALDH1A1 (0.60) PPARGPPARAPPARDF7F3
SCHEMBL14166998 0.88 FFAR4 (0.61) PPARGPPARAPPARDPTPN1HSD17B10
SCHEMBL1593287 0.88 FFAR4 (0.61) PPARGPPARAPPARDPTPN1HSD17B10

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-2547322-A2 USE OF NITROCARBOXYLIC ACIDS FOR THE TREATMENT, DIAGNOSIS AND PROPHYLAXIS OF AGGRESSIVE HEALING PATTERNS Dietz, Ulrich (DE) 2013-01-23 — — EP disclosed
WO-2011113507-A2 USE OF NITROCARBOXYLIC ACIDS FOR THE TREATMENT, DIAGNOSIS AND PROPHYLAXIS OF AGGRESSIVE HEALING PATTERNS DIETZ ULRICH (DE) 2011-09-22 — — WO disclosed
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