SCHEMBL19821885

SCHEMBL19821885

CCC(C)C(=O)OCCCC(=O)NC

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.38
LMNA P02545 1/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 1/20 0.34
FAAH O00519 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 2/20 0.32
POLB P06746 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL19821856 0.89 LMNA (0.38) EPHX1LMNAPOLBCHRNB2CHRNA4
SCHEMBL19822013 0.83 KMT2A (0.35) KMT2AMEN1FAAHMAPK1SMN1; SMN2
SCHEMBL19821799 0.80 TSHR (0.50) LMNAALDH1A1
SCHEMBL26363347 0.79 ALDH1A1 (0.34) KMT2AMEN1FAAHCHRNB2CHRNA4
SCHEMBL13645125 0.79 AKR1B1 (0.41) KMT2AMEN1ALDH1A1
SCHEMBL12796462 0.79 ALDH1A1 (0.34) ALDH1A1
SCHEMBL19821979 0.78 KDM4E (0.38) EPHX1LMNASMN1; SMN2ALDH1A1
SCHEMBL19821876 0.77 ALDH1A1 (0.40) LMNAKMT2AMEN1SMN1; SMN2POLB
SCHEMBL8954874 0.77 ALDH1A1 (0.54) EPHX1LMNAMAPK1SMN1; SMN2HPGD
SCHEMBL13541256 0.77 ALDH1A1 (0.54) EPHX1LMNAMAPK1SMN1; SMN2HPGD

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-20230129965-A1 HYDROPHILIC AND OLEOPHOBIC POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-04-27 US disclosed
US-20180030175-A1 POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-01 US disclosed