SCHEMBL9833833

SCHEMBL9833833

O=C(CCCc1ccccc1)N(O)CCc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 11/20 1.00
KDM4A O75164 2/20 0.71
KDM4C Q9H3R0 2/20 0.71
KDM5A P29375 1/20 0.71
PHF8 Q9UPP1 1/20 0.71
KDM2A Q9Y2K7 1/20 0.71
HDAC3 O15379 3/20 0.58
HDAC1 Q13547 3/20 0.58
HDAC2 Q92769 3/20 0.58
HDAC8 Q9BY41 3/20 0.58
HDAC6 Q9UBN7 3/20 0.58
HDAC5 Q9UQL6 3/20 0.58
HDAC4 P56524 2/20 0.58
HDAC7 Q8WUI4 2/20 0.58
HDAC10 Q969S8 2/20 0.58
HDAC11 Q96DB2 2/20 0.58
HDAC9 Q9UKV0 2/20 0.58
MAPK1 P28482 1/20 0.58
ADRA1A P35348 1/20 0.58
SLC6A3 Q01959 1/20 0.58

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
SCHEMBL10691673 0.95 ALOX5 (0.90) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL10692283 0.88 ALOX5 (0.79) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL10697496 0.87 ALOX5 (1.00) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL9834381 0.87 ALOX5 (0.77) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL9835077 0.86 ALOX5 (1.00) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL10695268 0.86 ALOX5 (1.00) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL9836200 0.85 ALOX5 (0.74) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL9836494 0.84 ALOX5 (0.72) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL9833716 0.84 ALOX5 (0.72) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL16352158 0.83 ALOX5 (0.70) ALOX5KDM4AKDM4CKDM5APHF8

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 6 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-0200377-B1 HYDROXAMATES SQUIBB & SONS INC (US) 1991-10-09 EP disclosed
US-4792560-A ANTIALLERGENS; ANTIINFLAMMATORY AGENTS RORER PHARMACEUTICAL CORPORATION (US) 1988-12-20 US disclosed
EP-0200377-A2 Hydroxamates E.R. Squibb & Sons, Inc. (US) 1986-11-05 EP disclosed
EP-0196674-A2 Hydroxamates as modulators of arachidonic acid metabolic pathways USV PHARMACEUTICAL CORPORATION (US) 1986-10-08 EP disclosed
US-4604407-A Hydroxamates E. R. SQUIBB & SONS, INC. (US) 1986-08-05 US disclosed