SCHEMBL4016012

SCHEMBL4016012

COC(=O)C(C=CC(=O)O)=CCCCCCC(C)C

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.36
HCAR2 Q8TDS4 6/20 0.34
KDM4C Q9H3R0 2/20 0.34
KDM4A O75164 1/20 0.34
PHF8 Q9UPP1 1/20 0.34
KDM2A Q9Y2K7 1/20 0.34
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL5169539 0.84 KDM1A (0.40) KDM1AHCAR2KDM4CKDM4APHF8
Maleic Acid SCHEMBL12077760 0.77 TSHR (0.45) KDM1AHCAR2KDM4CKDM4APHF8
SCHEMBL28250521 0.76 KDM1A (0.37) KDM1AKDM4CKDM4APHF8KDM2A
SCHEMBL26087793 0.76 KDM1A (0.37) KDM1AKDM4CKDM4APHF8KDM2A
SCHEMBL23924379 0.72 PTPN1 (0.45) KDM1AKDM4CKDM4APHF8KDM2A
SCHEMBL301125 0.72 PTPN1 (0.45) KDM1AKDM4CKDM4APHF8KDM2A
SCHEMBL5654028 0.72 PTPN1 (0.45) KDM1AKDM4CKDM4APHF8KDM2A
SCHEMBL9751266 0.72 PTPN1 (0.45) KDM1AKDM4CKDM4APHF8KDM2A
SCHEMBL22555602 0.72 PTPN1 (0.45) KDM1AKDM4CKDM4APHF8KDM2A
SCHEMBL5654019 0.72 PTPN1 (0.45) KDM1AKDM4CKDM4APHF8KDM2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1490734-B1 TIME OR TIME-TEMPERATURE INDICATING ARTICLES 3M INNOVATIVE PROPERTIES CO (US) 2009-06-24 EP disclosed