SCHEMBL23766623

SCHEMBL23766623

CC(O)COC(=O)C(O)c1cc(C(O)C(=O)O)cc(C(O)C(=O)OC(C)CO)c1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TSHR P16473 1/20 0.33
MAPT P10636 1/20 0.32
LMNA P02545 2/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL23766622 0.82 MAPT (0.39) TSHRMAPTLMNAMAPK1
SCHEMBL821949 0.74 LMNA (0.47) BLMTSHRMAPTLMNAMAPK1
SCHEMBL821940 0.71 LMNA (0.50) BLMNPSR1TSHRLMNAMAPK1
SCHEMBL12262559 0.68 MAPT (0.39) TSHRMAPTLMNAMAPK1
SCHEMBL11487337 0.66 LMNA (0.50) BLMNPSR1TSHRLMNAMAPK1
SCHEMBL11451034 0.66 LMNA (0.50) BLMNPSR1TSHRLMNAMAPK1
SCHEMBL9140378 0.65 MAPT (0.41) TSHRMAPTLMNA
SCHEMBL7773086 0.65 TSHR (0.42) TSHR
SCHEMBL21116668 0.64 MAPT (0.31) MAPT
SCHEMBL16217654 0.64 ADRB2 (0.45) MAPT

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-20210253517-A1 METHOD FOR PRODUCING AMINO ACID AMINOALKYL ESTER OR INORGANIC ACID SALT THEREOF ASAHI KASEI KABUSHIKI KAISHA (JP) 2021-08-19 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-20210253517-A1 METHOD FOR PRODUCING AMINO ACID AMINOALKYL ESTER OR INORGANIC ACID SALT THEREOF SLC6A15, SLC6A19, ALAD BLM 3135/4885NPSR1 2331/4885TSHR 3390/4885

“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.