SCHEMBL2531343

SCHEMBL2531343

CC(C)CCCC(=O)CCO

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.41
BLM P54132 1/20 0.39
PTPN1 P18031 2/20 0.38
KDM1A O60341 1/20 0.38
KDM4C Q9H3R0 2/20 0.35
KDM4A O75164 1/20 0.35
PHF8 Q9UPP1 1/20 0.35
KDM2A Q9Y2K7 1/20 0.35
LMNA P02545 1/20 0.35
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA4 P43681 1/20 0.33
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
GBA1 P04062 1/20 0.31

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
SCHEMBL27535451 0.91 KDM4C (0.44) CA1BLMKDM4CKDM4APHF8
SCHEMBL2533371 0.91 CA1 (0.41) CA1BLMPTPN1KDM1AKDM4C
SCHEMBL5613242 0.90 CA1 (0.48) CA1BLMPTPN1KDM1AKDM4C
SCHEMBL2531310 0.88 GPR84 (0.41) CA1BLMPTPN1KDM1AKDM4C
SCHEMBL2523653 0.86 GPR84 (0.44) CA1BLMPTPN1KDM1AKDM4C
SCHEMBL2533303 0.86 GPR84 (0.44) CA1BLMPTPN1KDM1AKDM4C
SCHEMBL2530431 0.85 CA1 (0.50) CA1BLM
SCHEMBL110410 0.85 CA1 (0.50) CA1BLMPTPN1KDM1AKDM4C
SCHEMBL2527461 0.85 CA1 (0.44) CA1BLMPTPN1KDM1AKDM4C
Phosphoric Acid SCHEMBL29108741 0.84 KDM4C (0.40) CA1BLMPTPN1KDM4CKDM4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461135-B2 Boron-containing small molecules as anti-inflammatory agents ANACOR PHARMACEUTICALS, INC. (US) 2013-06-11 US claimed
US-8039450-B2 Boron-containing small molecules as anti-inflammatory agents ANACOR PHARMACEUTICALS, INC. (US) 2011-10-18 US claimed