SCHEMBL10692791

SCHEMBL10692791

CCCN(O)C(=O)Cc1ccc(OCc2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 12/20 1.00
LTB4R Q15722 1/20 0.64
LTB4R2 Q9NPC1 1/20 0.64
PTGS1 P23219 1/20 0.59
PTGS2 P35354 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.54
BCHE P06276 2/20 0.52
MAOB P27338 1/20 0.51

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
SCHEMBL10693993 0.88 ALOX5 (1.00) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL10692771 0.85 ALOX5 (1.00) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL10689449 0.85 ALOX5 (1.00) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL2755055 0.84 ALOX5 (1.00) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL10695836 0.82 ALOX5 (0.88) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL10692128 0.82 ALOX5 (0.88) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL3132030 0.81 ALOX5 (0.83) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL10694636 0.80 ALOX5 (0.67) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL10691196 0.80 ALOX5 (0.74) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL2353230 0.78 ALOX5 (0.76) ALOX5LTB4RLTB4R2PTGS1PTGS2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0196674-A2 Hydroxamates as modulators of arachidonic acid metabolic pathways USV PHARMACEUTICAL CORPORATION (US) 1986-10-08 EP claimed
US-4792560-A ANTIALLERGENS; ANTIINFLAMMATORY AGENTS RORER PHARMACEUTICAL CORPORATION (US) 1988-12-20 US disclosed
EP-0196674-A2 Hydroxamates as modulators of arachidonic acid metabolic pathways USV PHARMACEUTICAL CORPORATION (US) 1986-10-08 EP disclosed