SCHEMBL10697496

SCHEMBL10697496

COc1ccc(CCCC(=O)N(O)CCc2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 13/20 1.00
ALDH1A1 P00352 1/20 0.59
KDM4A O75164 1/20 0.57
KDM5A P29375 1/20 0.57
KDM4C Q9H3R0 1/20 0.57
PHF8 Q9UPP1 1/20 0.57
KDM2A Q9Y2K7 1/20 0.57
PLAAT3 P53816 1/20 0.56
PLAAT5 Q96KN8 1/20 0.56
PLAAT2 Q9NWW9 1/20 0.56
PLAAT4 Q9UL19 1/20 0.56
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54

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
SCHEMBL9833833 0.87 ALOX5 (1.00) ALOX5KDM4AKDM5AKDM4CPHF8
SCHEMBL10695970 0.86 ALOX5 (1.00) ALOX5ALDH1A1NPC1RAB9A
SCHEMBL7448130 0.83 ALOX5 (0.70) ALOX5ALDH1A1KDM4AKDM5AKDM4C
SCHEMBL10691673 0.82 ALOX5 (0.90) ALOX5KDM4AKDM5AKDM4CPHF8
SCHEMBL31329298 0.81 ALOX5 (0.68) ALOX5ALDH1A1PLAAT3PLAAT5PLAAT2
SCHEMBL10691859 0.81 ALOX5 (1.00) ALOX5ALDH1A1
SCHEMBL31329279 0.80 ALOX5 (0.69) ALOX5ALDH1A1PLAAT3PLAAT5PLAAT2
SCHEMBL3049698 0.80 ALOX5 (0.68) ALOX5KDM4AKDM5AKDM4CPHF8
SCHEMBL9834381 0.79 ALOX5 (0.77) ALOX5KDM4AKDM5AKDM4CPHF8
SCHEMBL31329297 0.78 ALOX5 (0.82) ALOX5ALDH1A1PLAAT3PLAAT5PLAAT2

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