SCHEMBL21785045

SCHEMBL21785045

O=C1NCCNC(=O)C(=O)NCCNC(=O)C(=O)NCCNC(=O)C(=O)NCCNC1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 3/20 0.47
OR51E2 Q9H255 1/20 0.37
GAA P10253 1/20 0.36
PARP10 Q53GL7 4/20 0.36
PARP1 P09874 3/20 0.36
PARP11 Q9NR21 3/20 0.36
PDPK1 O15530 1/20 0.36
CHEK1 O14757 2/20 0.36
DAPK3 O43293 2/20 0.36
PRKD3 O94806 2/20 0.36
MAP4K4 O95819 2/20 0.36
RET P07949 2/20 0.36
FGFR1 P11362 2/20 0.36
FLT1 P17948 2/20 0.36
LTK P29376 2/20 0.36
GRK5 P34947 2/20 0.36
CSNK1A1 P48729 2/20 0.36
CDK8 P49336 2/20 0.36
CDK7 P50613 2/20 0.36
RPS6KA3 P51812 2/20 0.36

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
SCHEMBL31059 1.00
SCHEMBL9058472 1.00 CRBN (0.47) CRBNOR51E2GAAPARP10PARP1
SCHEMBL867128 0.96
Calcium SCHEMBL29977738 0.96
Water SCHEMBL29871097 0.96 CRBN (0.44) CRBNOR51E2GAAPARP10PARP1
Bromide SCHEMBL19411899 0.96
Ammonia Solution, Strong SCHEMBL8471093 0.96 CRBN (0.44) CRBNOR51E2GAAPARP10PARP1
SCHEMBL32662853 0.96
Hydrochloric Acid SCHEMBL5740143 0.96 CRBN (0.44) CRBNOR51E2GAAPARP10PARP1
SCHEMBL2672858 0.96

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
US-20200075998-A1 CYCLIC COMPOUND, ANODE FOR LITHIUM ION SECONDARY BATTERY, AND LITHIUM ION SECONDARY BATTERY MURATA MANUFACTURING CO., LTD. (JP) 2020-03-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200075998-A1 CYCLIC COMPOUND, ANODE FOR LITHIUM ION SECONDARY BATTERY, AND LITHIUM ION SECONDARY BATTERY CLK2, CLK4, CACNA2D3 CRBN 3038/4885OR51E2 2999/4885GAA 2101/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.