SCHEMBL28403292

SCHEMBL28403292

CC(C(=O)O)=C(N)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
ALOX15 P16050 1/20 0.37
BLM P54132 1/20 0.37
PMP22 Q01453 1/20 0.37
LDHA P00338 1/20 0.35
LDHB P07195 1/20 0.35
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
ACHE P22303 1/20 0.32
FFAR3 O14843 1/20 0.32
LCK P06239 1/20 0.32
FYN P06241 1/20 0.32
TDP1 Q9NUW8 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 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
SCHEMBL7567060 0.76 LMNA (0.35) LMNAALOX15BLMPMP22LDHA
SCHEMBL21001300 0.76 LMNA (0.35) LMNAALOX15BLMPMP22LDHA
SCHEMBL8985924 0.72 ALDH1A1 (0.39) LMNAALOX15BLMPMP22ALDH1A1
SCHEMBL7558928 0.71 FFAR3 (0.35) ALDH1A1TSHRFFAR3LCKFYN
SCHEMBL20550221 0.71 FFAR3 (0.35) ALDH1A1TSHRFFAR3LCKFYN
SCHEMBL5038778 0.71 FFAR3 (0.35) ALDH1A1TSHRFFAR3LCKFYN
SCHEMBL7558925 0.71 FFAR3 (0.35) ALDH1A1TSHRFFAR3LCKFYN
SCHEMBL5038782 0.71 FFAR3 (0.35) ALDH1A1TSHRFFAR3LCKFYN
SCHEMBL1704654 0.69
SCHEMBL20237254 0.69

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
CN-106520913-B Preparation method of graphene oxide-DNA sensor based on enzyme digestion cycle amplification and application of graphene oxide-DNA sensor in thrombin detection 江苏大学 2020-02-21 CN claimed