SCHEMBL9835783

SCHEMBL9835783

CC(C)CN(O)C(=O)CCCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 7/20 0.67
KDM4A O75164 1/20 0.56
KDM5A P29375 1/20 0.56
KDM4C Q9H3R0 1/20 0.56
PHF8 Q9UPP1 1/20 0.56
KDM2A Q9Y2K7 1/20 0.56
LMNA P02545 1/20 0.55
PKM P14618 1/20 0.55
HPGD P15428 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.51
HDAC3 O15379 2/20 0.51
HDAC4 P56524 2/20 0.51
HDAC1 Q13547 2/20 0.51
HDAC7 Q8WUI4 2/20 0.51
HDAC2 Q92769 2/20 0.51
HDAC10 Q969S8 2/20 0.51
HDAC11 Q96DB2 2/20 0.51
HDAC8 Q9BY41 2/20 0.51
HDAC6 Q9UBN7 2/20 0.51
HDAC9 Q9UKV0 2/20 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
SCHEMBL7605182 0.84 ALOX5 (0.58) ALOX5KDM4AKDM5AKDM4CPHF8
SCHEMBL9833833 0.80 ALOX5 (1.00) ALOX5KDM4AKDM5AKDM4CPHF8
SCHEMBL9835077 0.80 ALOX5 (1.00) ALOX5KDM4AKDM5AKDM4CPHF8
SCHEMBL1377574 0.79 ALOX5 (0.58) ALOX5KDM4AKDM5AKDM4CPHF8
SCHEMBL28449798 0.79 ALOX5 (0.51) ALOX5KDM4AKDM5AKDM4CPHF8
SCHEMBL9834381 0.78 ALOX5 (0.77) ALOX5KDM4AKDM5AKDM4CPHF8
SCHEMBL9836200 0.77 ALOX5 (0.74) ALOX5KDM4AKDM5AKDM4CPHF8
SCHEMBL8493143 0.76 ALOX5 (0.69) ALOX5KDM4AKDM5AKDM4CPHF8
SCHEMBL10692283 0.76 ALOX5 (0.79) ALOX5KDM4AKDM5AKDM4CPHF8
SCHEMBL9833716 0.76 ALOX5 (0.72) ALOX5KDM4AKDM5AKDM4CPHF8

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