SCHEMBL7424799

SCHEMBL7424799

COC(=O)C(CC(=O)O)N(CCC(C)C)C(=O)OC

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 2/20 0.33
KDM4A O75164 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
EPOR P19235 1/20 0.31
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
POLB P06746 1/20 0.30
THRB P10828 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
MME P08473 1/20 0.30

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
SCHEMBL7382102 0.71 SLC1A3 (0.34) KDM4CKDM4APHF8KDM2ALMNA
SCHEMBL28789567 0.67 EPOR (0.34) EPOR
SCHEMBL23986454 0.66 CHRNB2 (0.41) KDM4CKDM4APHF8KDM2ALMNA
SCHEMBL27014703 0.65 CA1 (0.43) KDM4CKDM4APHF8KDM2A
SCHEMBL16393836 0.65 KMT2A (0.46) EPORLMNATP53NPSR1
SCHEMBL28488965 0.65 GPR84 (0.36) KDM4CKDM4APHF8
SCHEMBL306435 0.64 CA12 (0.37)
SCHEMBL304559 0.64 MC4R (0.35) KDM4CKDM4APHF8KDM2ALMNA
SCHEMBL27588072 0.64
SCHEMBL14826530 0.64 TSHR (0.34) EPORLMNA

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
WO-2002039997-A2 ACE-2 MODULATING COMPOUNDS AND USE THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2002-05-23 WO disclosed