SCHEMBL4901518

SCHEMBL4901518

CC(O)C(OC(=O)O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.43
MAPK1 P28482 1/20 0.43
HCAR2 Q8TDS4 1/20 0.43
KMT2A Q03164 1/20 0.42
CYP3A4 P08684 2/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2C P18825 1/20 0.41
HIF1A Q16665 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP2D6 P10635 1/20 0.40
HPGD P15428 1/20 0.40
SRC P12931 1/20 0.40
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
HTT P42858 1/20 0.39
KLK7 P49862 1/20 0.39
TSHR P16473 1/20 0.39
ALOX5 P09917 1/20 0.39

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
SCHEMBL980836 0.85 CYP2D6 (0.48) LMNAMAPK1HCAR2KMT2ACYP3A4
SCHEMBL28764377 0.85 CYP1A2 (0.44) LMNAMAPK1HCAR2KMT2ACYP3A4
SCHEMBL28615505 0.82 ADRA2A (0.48) LMNAMAPK1HCAR2KMT2ACYP3A4
SCHEMBL27278688 0.82 CYP3A4 (0.44) LMNAMAPK1HCAR2KMT2ACYP3A4
SCHEMBL15899493 0.81 CYP3A4 (0.46) HCAR2KMT2ACYP3A4ALDH1A1CYP2D6
SCHEMBL13130581 0.79 CHRM2 (0.44) LMNAHCAR2KMT2ACYP3A4KDM4E
SCHEMBL18980935 0.79 LMNA (0.46) LMNAMAPK1KMT2ACYP3A4ADRA2A
SCHEMBL28244352 0.78 TACR3 (0.49) LMNAKMT2AHTT
SCHEMBL27801807 0.78 CYP2D6 (0.41) LMNAMAPK1HCAR2KMT2ACYP3A4
SCHEMBL27780426 0.78 LMNA (0.42) LMNAMAPK1HCAR2KMT2ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4082729-A PROCESS FOR THE PREPARATION OF OXYMETHYLENE POLYMERS HOECHST AKTIENGESELLSCHAFT (DT) 1978-04-04 US claimed
US-20080097077-A1 Method For Producing Polyoxymethylenes BASF AKTIENGESELLSCHAFT (DE) 2008-04-24 US disclosed
US-4082729-A PROCESS FOR THE PREPARATION OF OXYMETHYLENE POLYMERS HOECHST AKTIENGESELLSCHAFT (DT) 1978-04-04 US disclosed