SCHEMBL8196802

SCHEMBL8196802

[CH2]C(=O)OC1CCCOC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GRM5 P41594 2/20 0.32
ACACB O00763 1/20 0.32
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
CTSL P07711 1/20 0.30
PRSS1 P07477 1/20 0.30
TPSAB1 Q15661 1/20 0.30
TPSD1 Q9BZJ3 1/20 0.30
TPSG1 Q9NRR2 1/20 0.30
NAAA Q02083 1/20 0.30
GPR119 Q8TDV5 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
SCHEMBL8188382 0.88
SCHEMBL4691011 0.82 EPHX1 (0.34) EPHX1L3MBTL1GRM5ACACBCTSL
SCHEMBL4566630 0.80 ATM (0.36) EPHX1GRM5ACACBJAK2JAK1
SCHEMBL16782377 0.80 ACACB (0.36) EPHX1GRM5ACACBNAAA
SCHEMBL4539270 0.80 ACACB (0.36) EPHX1GRM5ACACBNAAA
SCHEMBL18319305 0.80 GRM5 (0.34) EPHX1GRM5ACACBNAAA
SCHEMBL10395496 0.79 ACACB (0.37) EPHX1L3MBTL1GRM5ACACBCTSL
SCHEMBL8187588 0.79 NAAA (0.38) EPHX1L3MBTL1GRM5ACACBNAAA
SCHEMBL28360817 0.78 CHRM2 (0.33) EPHX1GRM5ACACB
SCHEMBL7691563 0.78

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
WO-2000021936-A1 URACIL HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-04-20 WO disclosed