SCHEMBL9834381

SCHEMBL9834381

CCCCN(O)C(=O)CCCc1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 9/20 0.77
KDM4C Q9H3R0 4/20 0.64
KDM4A O75164 3/20 0.64
KDM5A P29375 2/20 0.64
PHF8 Q9UPP1 1/20 0.64
KDM2A Q9Y2K7 1/20 0.64
HDAC3 O15379 1/20 0.51
MAPK1 P28482 1/20 0.51
ADRA1A P35348 1/20 0.51
HDAC4 P56524 1/20 0.51
SLC6A3 Q01959 1/20 0.51
HDAC1 Q13547 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HDAC9 Q9UKV0 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
SCHEMBL9836200 0.95 ALOX5 (0.74) ALOX5KDM4CKDM4AKDM5APHF8
SCHEMBL9833716 0.94 ALOX5 (0.72) ALOX5KDM4CKDM4AKDM5APHF8
SCHEMBL9836494 0.94 ALOX5 (0.72) ALOX5KDM4CKDM4AKDM5APHF8
SCHEMBL14553382 0.92 ALOX5 (0.79) ALOX5KDM4CKDM4AKDM5APHF8
SCHEMBL28147120 0.91 ALOX5 (0.72) ALOX5KDM4CKDM4AKDM5APHF8
SCHEMBL9833833 0.87 ALOX5 (1.00) ALOX5KDM4CKDM4AKDM5APHF8
SCHEMBL10692283 0.86 ALOX5 (0.79) ALOX5KDM4CKDM4AKDM5APHF8
SCHEMBL4085934 0.84 ALOX5 (0.57) ALOX5KDM4CKDM4AKDM5APHF8
SCHEMBL10695268 0.83 ALOX5 (1.00) ALOX5KDM4CKDM4AKDM5APHF8
SCHEMBL19289874 0.82 ALOX5 (0.63) ALOX5KDM4CKDM4AKDM5APHF8

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-0200377-B1 HYDROXAMATES SQUIBB & SONS INC (US) 1991-10-09 EP disclosed
EP-0200377-A2 Hydroxamates E.R. Squibb & Sons, Inc. (US) 1986-11-05 EP disclosed
US-4604407-A Hydroxamates E. R. SQUIBB & SONS, INC. (US) 1986-08-05 US disclosed