SCHEMBL17409146

SCHEMBL17409146

COBOC(=O)c1ccc(C(C)=O)o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.41
MEN1 O00255 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 1/20 0.41
HTT P42858 3/20 0.40
GLA P06280 2/20 0.40
TSHR P16473 1/20 0.40
ALDH1A1 P00352 6/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
HDAC4 P56524 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
LMNA P02545 2/20 0.34
RECQL P46063 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KDM4E B2RXH2 2/20 0.33

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
SCHEMBL3140257 0.79 MEN1 (0.61) KMT2AMEN1CYP1A2CYP2C19HTT
SCHEMBL22845659 0.77 KMT2A (0.44) KMT2AMEN1CYP1A2CYP2C19HTT
SCHEMBL54682 0.76 KMT2A (0.46) KMT2AMEN1CYP1A2CYP2C19HTT
SCHEMBL12140121 0.74 ALDH1A1 (0.54) KMT2AMEN1CYP1A2CYP2C19HTT
SCHEMBL24467151 0.73 HDAC4 (0.42) KMT2AMEN1CYP1A2CYP2C19HTT
SCHEMBL24467119 0.73 KMT2A (0.42) KMT2AMEN1CYP1A2CYP2C19HTT
SCHEMBL23544342 0.72 KMT2A (0.41) KMT2AMEN1CYP1A2CYP2C19HTT
SCHEMBL12400282 0.71 HDAC4 (0.45) KMT2AMEN1CYP1A2CYP2C19HTT
SCHEMBL1828976 0.70 HDAC4 (0.65) KMT2AMEN1CYP1A2TSHRALDH1A1
SCHEMBL16543897 0.70 TSHR (0.51) KMT2AMEN1CYP1A2CYP2C19HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170267812-A1 Process to Prepare a Polyester Polymer Composition Comprising a Polyester Polymer Having Furanic Units and a Polyester Polymer Composition Obtainable Thereby and the Use Thereof SULZER CHEMTECH AG (CH) 2017-09-21 US disclosed
US-20160002397-A1 A Process to Prepare a Polyester Polymer Composition Comprising a Polyester Polymer Having Furanic Units and a Polyester Polymer Composition Obtainable Thereby and the use Thereof SULZER CHEMTECH AG (CH) 2016-01-07 US disclosed