SCHEMBL9506981

SCHEMBL9506981

O=C(c1ccc(OCc2ccccc2)cc1)N(O)CCc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 1.00
NR4A1 P22736 1/20 0.60
NR4A2 P43354 1/20 0.60
NR4A3 Q92570 1/20 0.60
MAOB P27338 1/20 0.57
PARP10 Q53GL7 1/20 0.57
LTB4R Q15722 1/20 0.56
LTB4R2 Q9NPC1 1/20 0.56
SRD5A2 P31213 1/20 0.56
FFAR1 O14842 1/20 0.56
FFAR4 Q5NUL3 1/20 0.56
EGFR P00533 2/20 0.56
PTGS1 P23219 1/20 0.55
PTGS2 P35354 1/20 0.55

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
SCHEMBL9374202 0.83 ALOX5 (0.73) ALOX5PARP10LTB4RLTB4R2FFAR1
SCHEMBL10693993 0.82 ALOX5 (1.00) ALOX5LTB4RLTB4R2FFAR1FFAR4
SCHEMBL9373373 0.82 ALOX5 (0.71) ALOX5LTB4RLTB4R2FFAR1FFAR4
SCHEMBL10695721 0.82 ALOX5 (0.80) ALOX5LTB4RLTB4R2FFAR1FFAR4
SCHEMBL9877598 0.81 ALOX5 (0.68) ALOX5NR4A1NR4A2NR4A3MAOB
SCHEMBL8200793 0.79 MAOB (0.69) ALOX5NR4A1NR4A2NR4A3MAOB
SCHEMBL11877158 0.78 NR4A1 (0.66) ALOX5NR4A1NR4A2NR4A3MAOB
SCHEMBL8894460 0.77 ALOX5 (0.63) ALOX5NR4A1NR4A2NR4A3MAOB
SCHEMBL10692128 0.77 ALOX5 (0.88) ALOX5NR4A2LTB4RLTB4R2FFAR1
SCHEMBL10695836 0.77 ALOX5 (0.88) ALOX5NR4A2LTB4RLTB4R2FFAR1

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-0196674-A2 Hydroxamates as modulators of arachidonic acid metabolic pathways USV PHARMACEUTICAL CORPORATION (US) 1986-10-08 EP claimed
EP-0161939-B1 ARYLHYDROXAMATES E.R. Squibb & Sons, Inc. (US) 1993-07-21 EP disclosed