SCHEMBL28520195

SCHEMBL28520195

C=C(CCC(=O)OCCCO)C(=O)OCCCO

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
BLM P54132 1/20 0.39
ADRA2A P08913 1/20 0.36
ADRA1A P35348 1/20 0.36
TSHR P16473 2/20 0.35
HTR2C P28335 1/20 0.35
DGKA P23743 1/20 0.34
MGLL Q99685 1/20 0.32
NAAA Q02083 1/20 0.31
POLB P06746 1/20 0.30
APEX1 P27695 1/20 0.30
HTT P42858 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
RAD52 P43351 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL7745098 0.86 TSHR (0.38) TSHR
SCHEMBL28520196 0.85 CAMK2A (0.43) TSHRPOLBAPEX1HTTTDP1
SCHEMBL1816515 0.83 ADRA2A (0.48) MAPTBLMADRA2AADRA1AHTR2C
SCHEMBL11417700 0.83 TSHR (0.50) MAPTBLMADRA2AADRA1ATSHR
SCHEMBL2367768 0.82 TSHR (0.36) TSHRNAAAPOLBAPEX1HTT
SCHEMBL27462340 0.82 TSHR (0.38) TSHR
SCHEMBL31390457 0.81 TSHR (0.47) TSHRDGKANAAARAD52NPSR1
SCHEMBL11763636 0.81 TSHR (0.35) TSHR
SCHEMBL2026788 0.81 TSHR (0.35) TSHR
SCHEMBL3980001 0.81 TSHR (0.35) TSHR

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
CN-112385076-A Separator for electrochemical device and method of manufacturing the same 株式会社LG化学 2021-02-19 CN disclosed