SCHEMBL28060067

SCHEMBL28060067

C=CC(=O)OOC(=O)C(C)(CC(=O)O)OCC

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
HMGCR P04035 1/20 0.31
CHRM1 P11229 1/20 0.31
TBXA2R P21731 1/20 0.31
ADRA1A P35348 1/20 0.31
THRB P10828 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
SCHEMBL28809232 0.73 TSHR (0.38) HPGDTSHRHMGCRCHRM1TBXA2R
SCHEMBL29048040 0.73 PKM (0.37) HPGDTSHRHMGCRCHRM1TBXA2R
SCHEMBL28060066 0.73 TSHR (0.33) HPGDTSHRTHRB
SCHEMBL7558348 0.69 TSHR (0.40) HPGDTSHRHMGCRCHRM1TBXA2R
Acrylic Acid Ethyl Ester SCHEMBL8921596 0.68 TSHR (0.44) HPGDTSHRHMGCRCHRM1TBXA2R
Ammonia Solution, Strong SCHEMBL28082914 0.68 TSHR (0.39) HPGDTSHRHMGCRCHRM1TBXA2R
SCHEMBL24754736 0.67 HMGCR (0.46) TSHRHMGCRCHRM1TBXA2RADRA1A
SCHEMBL28060519 0.67 THRB (0.37) HPGDTSHRTHRB
SCHEMBL28243169 0.66 HMGCR (0.37) HPGDTSHRHMGCRCHRM1TBXA2R
SCHEMBL17393728 0.66 TSHR (0.41) HPGDTSHRHMGCRCHRM1TBXA2R

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
CN-109075380-A Nonaqueous secondary battery 日本瑞翁株式会社 2018-12-21 CN disclosed
CN-107710472-A Use in electrode for secondary battery adhesive composition, use in electrode for secondary battery conductive material paste composite, slurry for secondary battery electrode composition, electrode for secondary battery and secondary cell 日本瑞翁株式会社 2018-02-16 CN disclosed
CN-101981727-B Perforated membrane and electrode for secondary battery ZEON CORP. (JP) 2016-03-30 CN disclosed