SCHEMBL20132373

SCHEMBL20132373

CCBN1C(=O)C=CC1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 14/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ BLM P54132 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ GMNN O75496 1/20 0.46
▸ THPO P40225 1/20 0.46
▸ PMP22 Q01453 1/20 0.46
▸ GSK3A P49840 2/20 0.39
▸ GSK3B P49841 2/20 0.39
▸ FAAH O00519 5/20 0.37
▸ PTGS1 P23219 3/20 0.37
▸ PTGS2 P35354 3/20 0.37
▸ HPGD P15428 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ WRN Q14191 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ HSP90AA1 P07900 2/20 0.33

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
SCHEMBL12936649 0.69 — —
SCHEMBL21162599 0.68 LMNA (0.31) LMNA
SCHEMBL21019700 0.67 MGLL (0.42) MGLLALDH1A1BLMLMNAMAPT
SCHEMBL9734841 0.64 MGLL (0.37) MGLLALDH1A1BLMLMNAMAPT
SCHEMBL19057261 0.63 MGLL (0.46) MGLLALDH1A1BLMLMNAMAPT
N-Ethylmaleimide SCHEMBL19666 0.63 — —
SCHEMBL20420335 0.63 — —
SCHEMBL18594707 0.63 — —
N-Ethylmaleimide SCHEMBL18209592 0.63 MGLL (1.00) MGLLALDH1A1BLMLMNAMAPT
SCHEMBL12640694 0.62 MGLL (0.44) MGLLALDH1A1BLMLMNAMAPT

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
US-20210230232-A1 SITE-SPECIFIC BIO-CONJUGATION METHODS AND COMPOSITIONS USEFUL FOR NANOPORE SYSTEMS Roche Sequencing Solutions, Inc. (US) 2021-07-29 — — US disclosed
US-11001611-B2 Site-specific bio-conjugation methods and compositions useful for nanopore systems Roche Sequencing Solutions, Inc. (US) 2021-05-11 — — US disclosed
US-20190002509-A1 SITE-SPECIFIC BIO-CONJUGATION METHODS AND COMPOSITIONS USEFUL FOR NANOPORE SYSTEMS Genia Technologies, Inc. (US) 2019-01-03 — — US disclosed
US-20180126000-A1 GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF ABBVIE INC. (US) 2018-05-10 — — 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 (4 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-20190002509-A1 SITE-SPECIFIC BIO-CONJUGATION METHODS AND COMPOSITIONS USEFUL FOR NANOPORE SYSTEMS APEX1, MSN, TIAL1 MGLL 3297/4885ALDH1A1 4864/4885BLM 376/4885
US-20180126000-A1 GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF NR3C1, NR3C2, MC2R MGLL 2461/4885ALDH1A1 3434/4885BLM 2995/4885
US-20210230232-A1 SITE-SPECIFIC BIO-CONJUGATION METHODS AND COMPOSITIONS USEFUL FOR NANOPORE SYSTEMS APEX1, MSN, TIAL1 MGLL 3297/4885ALDH1A1 4864/4885BLM 376/4885
US-11001611-B2 Site-specific bio-conjugation methods and compositions useful for nanopore systems APEX1, MSN, TIAL1 MGLL 3297/4885ALDH1A1 4864/4885BLM 376/4885

“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.

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