SCHEMBL19821865

SCHEMBL19821865

CCC(C)(C)C(=O)OCC(O)CC(=O)NC

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 5/20 0.36
ADRB2 P07550 5/20 0.31
ADRB1 P08588 5/20 0.31
ADRB3 P13945 5/20 0.31
LMNA P02545 1/20 0.31
PRKCA P17252 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC6 Q9UBN7 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
SCHEMBL19821927 0.84 HMGCR (0.35) HMGCRADRB2ADRB1ADRB3
SCHEMBL12135548 0.82 HMGCR (0.40) HMGCRADRB2ADRB1ADRB3LMNA
SCHEMBL19821806 0.82 HMGCR (0.37) HMGCRADRB2ADRB1ADRB3LMNA
SCHEMBL26363187 0.81 HMGCR (0.50) HMGCRLMNA
SCHEMBL26363333 0.80 HMGCR (0.38) HMGCRADRB2ADRB1ADRB3LMNA
SCHEMBL19822034 0.80 ADRB2 (0.38) ADRB2ADRB1ADRB3
SCHEMBL8986670 0.79 HMGCR (0.41) HMGCRADRB2ADRB1ADRB3LMNA
SCHEMBL19821968 0.78 ADRB2 (0.40) HMGCRADRB2ADRB1ADRB3
SCHEMBL19428724 0.78 HMGCR (0.37) HMGCRADRB2ADRB1ADRB3LMNA
SCHEMBL116867 0.78 LMNA (0.46) HMGCRLMNAPRKCA

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