SCHEMBL1128973

SCHEMBL1128973

CCCCCCN(CCCCCC)C(=O)CC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 5/20 0.49
PHF8 Q9UPP1 4/20 0.49
KDM4C Q9H3R0 4/20 0.49
GPR84 Q9NQS5 7/20 0.46
PPARG P37231 7/20 0.46
PPARD Q03181 7/20 0.46
PPARA Q07869 7/20 0.46
HDAC11 Q96DB2 5/20 0.46
TSHR P16473 4/20 0.46
PTPN1 P18031 3/20 0.46
ALDH1A1 P00352 2/20 0.46
TLR2 O60603 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
FABP4 P15090 2/20 0.46
SLC22A6 Q4U2R8 1/20 0.46
SLC22A8 Q8TCC7 1/20 0.46
MEN1 O00255 1/20 0.46
ESR1 P03372 1/20 0.46
ALOX15 P16050 1/20 0.46
PDE4A P27815 1/20 0.46

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
SCHEMBL1129612 0.91 CA12 (0.50) KDM5APHF8KDM4CALDH1A1KDM5C
SCHEMBL944778 0.89 CA12 (0.50) KDM5APHF8KDM4CKDM5CKDM5B
SCHEMBL23748010 0.89 CA12 (0.50) KDM5APHF8KDM4CKDM5CKDM5B
SCHEMBL3625206 0.87 CA12 (0.48) KDM5APHF8KDM4CALDH1A1KDM5C
SCHEMBL11357421 0.83 CA12 (0.45) KDM5APHF8KDM4CKDM5CKDM5B
SCHEMBL10890038 0.82 KDM5A (0.61) KDM5APHF8KDM4CGPR84PPARG
SCHEMBL10630552 0.82 KDM5A (0.61) KDM5APHF8KDM4CGPR84PPARG
SCHEMBL11315449 0.82 CA12 (0.44) KDM5APHF8KDM4CMEN1KMT2A
SCHEMBL14566020 0.82 GPR84 (0.56) KDM5APHF8KDM4CGPR84PPARG
SCHEMBL10341598 0.82 CA12 (0.44) KDM5APHF8KDM4CMEN1KMT2A

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-1996602-B1 NOVEL LACTOSAMINE DERIVATIVES GLYCOM APS (DK) 2011-02-16 EP disclosed