SCHEMBL21628119

SCHEMBL21628119

CCCC(CC(=O)O)C(CCC)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.48
CHRM1 P11229 1/20 0.44
AKR1A1 P14550 1/20 0.44
CHRM3 P20309 1/20 0.44
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
ADRA1A P35348 1/20 0.44
HRH1 P35367 1/20 0.44
DRD3 P35462 1/20 0.44
SLC6A3 Q01959 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
GPR84 Q9NQS5 4/20 0.39
CYP3A4 P08684 2/20 0.38
TSHR P16473 2/20 0.38
NFKB1 P19838 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
FOLH1 Q04609 1/20 0.35
GRIK1 P39086 1/20 0.35

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
SCHEMBL6049840 0.89 TDP1 (0.48) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL19991450 0.89 TDP1 (0.46) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL25637980 0.84 TDP1 (0.56) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL5079729 0.84 HDAC1 (0.48) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL5079726 0.84 HDAC1 (0.48) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL6633039 0.82 TDP1 (0.67) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL20564459 0.81 TDP1 (0.52) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL27725183 0.80 GPR84 (0.56) GPR84TSHRGRIK1GRIK2CA2
SCHEMBL8356801 0.80 GPR84 (0.56) GPR84TSHRGRIK1GRIK2CA2
SCHEMBL28718230 0.79 TDP1 (0.50) TDP1CHRM1AKR1A1CHRM3HTR2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110462888-B Positive electrode for electrochemical device and electrochemical device provided with same 松下知识产权经营株式会社 2022-08-26 CN disclosed
US-11081689-B2 Positive electrode for electrochemical device, and electrochemical device provided therewith PANASONIC INTELLECTUAL PROPERTY MANAGEMENT CO., LTD. (JP) 2021-08-03 US disclosed
US-20200035994-A1 POSITIVE ELECTRODE FOR ELECTROCHEMICAL DEVICE, AND ELECTROCHEMICAL DEVICE PROVIDED THEREWITH PANASONIC INTELLECTUAL PROPERTY MANAGEMENT CO., LTD. (JP) 2020-01-30 US disclosed
CN-110462888-A Anode used for electrochemical equipment and the electrochemical appliance for having it PANASONIC IP MAN CO LTD 2019-11-15 CN disclosed