SCHEMBL28636291

SCHEMBL28636291

CCCCCC=CC(OC)OC=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.42
TRPV1 Q8NER1 2/20 0.42
ALDH1A1 P00352 4/20 0.40
TP53 P04637 2/20 0.40
TSHR P16473 2/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 3/20 0.37
GMNN O75496 2/20 0.37
LMNA P02545 2/20 0.37
GLA P06280 2/20 0.37
POLB P06746 2/20 0.37
THRB P10828 2/20 0.37
CETP P11597 2/20 0.37
MAPK1 P28482 2/20 0.37
CXCR5 P32302 2/20 0.37
CCR6 P51684 2/20 0.37
BLM P54132 2/20 0.37
UBE2N P61088 2/20 0.37

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
SCHEMBL7590480 0.83 MEN1 (0.48) FAAHTRPV1ALDH1A1TP53MEN1
SCHEMBL7590475 0.83 MEN1 (0.48) FAAHTRPV1ALDH1A1TP53MEN1
SCHEMBL30487053 0.83 MEN1 (0.48) FAAHTRPV1ALDH1A1TP53MEN1
SCHEMBL5815237 0.78 MEN1 (0.38) TRPV1ALDH1A1TP53TSHRMEN1
SCHEMBL9113984 0.78 MEN1 (0.38) TRPV1ALDH1A1TP53TSHRMEN1
Acetic Acid SCHEMBL28405580 0.77 ALDH1A1 (0.49) FAAHALDH1A1TP53MEN1KMT2A
SCHEMBL1200516 0.71 MEN1 (0.44) FAAHTRPV1ALDH1A1TP53MEN1
SCHEMBL28636375 0.70 FAAH (0.45) FAAHTRPV1ALDH1A1TP53TSHR
SCHEMBL28636298 0.70 FAAH (0.45) FAAHTRPV1ALDH1A1TP53TSHR
SCHEMBL28634058 0.70 FAAH (0.45) FAAHTRPV1ALDH1A1TP53TSHR

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-113443971-A Method for producing alkynylalkoxymethyl ether compound and method for producing conjugated diene compound therefrom 信越化学工业株式会社 2021-09-28 CN disclosed