SCHEMBL21202245

SCHEMBL21202245

CCCC(C)CCOC(=O)C(CCC#N)C(=O)OC

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CHRNB2 P17787 2/20 0.30
CHRNB4 P30926 2/20 0.30
CHRNA3 P32297 2/20 0.30
CHRNA4 P43681 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
ZDHHC7 Q9NXF8 1/20 0.30
TSHR P16473 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
SCHEMBL21475350 0.81 ZDHHC7 (0.44) CA1CA2ZDHHC7TSHR
SCHEMBL21202147 0.81 ZDHHC7 (0.44) CA1CA2ZDHHC7TSHR
SCHEMBL21202150 0.81 ZDHHC7 (0.44) CA1CA2ZDHHC7TSHR
SCHEMBL19105368 0.81 TSHR (0.38) CA1CA2MEN1KMT2AZDHHC7
SCHEMBL21473630 0.80 ACE2 (0.41) ALOX15CA1CA2TSHR
SCHEMBL19105381 0.80 TSHR (0.38) MEN1KMT2ATSHR
SCHEMBL19105332 0.77 TSHR (0.45) CA1CA2MEN1KMT2ATSHR
SCHEMBL19117254 0.76 TSHR (0.38) MEN1KMT2ATSHR
SCHEMBL21202246 0.75 CTSS (0.35) ALOX15MEN1KMT2A
SCHEMBL19116885 0.75 TSHR (0.41) CA1CA2MEN1KMT2ATSHR

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-10950891-B2 Diester-based polymer electrolytes for high voltage lithium ion batteries ROBERT BOSCH GMBH (DE) 2021-03-16 US disclosed
US-20190319307-A1 DIESTER-BASED POLYMER ELECTROLYTES FOR HIGH VOLTAGE LITHIUM ION BATTERIES SEEO, INC. (US) 2019-10-17 US disclosed
US-10367228-B2 Diester-based polymer electrolytes for high voltage lithium ion batteries SEEO, INC. (US) 2019-07-30 US disclosed