SCHEMBL8942318

SCHEMBL8942318

CC(Oc1ccc(C(=O)N(O)CCNC(N)=O)cc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.52
LTB4R Q15722 8/20 0.49
LTB4R2 Q9NPC1 8/20 0.49
FFAR1 O14842 1/20 0.45
KCNH2 Q12809 1/20 0.42
SCN3A Q9NY46 1/20 0.42
S1PR5 Q9H228 2/20 0.40
S1PR1 P21453 1/20 0.40
BRD4 O60885 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
BCAT2 O15382 1/20 0.37

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
SCHEMBL8942395 0.89 ALOX5 (0.47) ALOX5LTB4RLTB4R2FFAR1KCNH2
SCHEMBL8782774 0.84 ALOX5 (0.55) ALOX5LTB4RLTB4R2FFAR1KCNH2
SCHEMBL8942302 0.82 ALOX5 (0.41) ALOX5LTB4RLTB4R2FFAR1BRD4
SCHEMBL8942484 0.82 PARP10 (0.50) ALOX5
SCHEMBL8942653 0.79 CA1 (0.47)
SCHEMBL8942623 0.78 HPGD (0.46) ALOX5
SCHEMBL8783047 0.76 ALOX5 (0.50) ALOX5BRD4
SCHEMBL8942585 0.75 MEN1 (0.42) ALOX5L3MBTL1
SCHEMBL8942432 0.75 RAB9A (0.46)
SCHEMBL8783028 0.73 ALOX5 (0.53) ALOX5LTB4RLTB4R2FFAR1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5514702-A Arylamidoalkyl-N-hydroxyurea compounds having lipoxygenase inhibitory activity ABBOTT LABORATORIES (US) 1996-05-07 US disclosed