SCHEMBL16424794

SCHEMBL16424794

CC(C)[C@H](N)C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)Nc1ccc(CO[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 3/20 0.47
▸ CA2 P00918 3/20 0.47
▸ MAPT P10636 6/20 0.46
▸ TDP1 Q9NUW8 5/20 0.46
▸ KDM4E B2RXH2 4/20 0.46
▸ GLA P06280 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ PAX8 Q06710 1/20 0.46
▸ NPSR1 Q6W5P4 3/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SIRT5 Q9NXA8 1/20 0.43
▸ POLB P06746 1/20 0.41
▸ SIRT2 Q8IXJ6 6/20 0.40
▸ SIRT1 Q96EB6 5/20 0.40
▸ SIRT3 Q9NTG7 3/20 0.40

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
SCHEMBL21597894 0.88 SIRT2 (0.37) SIRT5SIRT2SIRT1SIRT3
SCHEMBL21597895 0.88 SIRT2 (0.37) SIRT5SIRT2SIRT1SIRT3
SCHEMBL16424839 0.87 CA1 (0.52) CA1CA2MAPTTDP1KDM4E
SCHEMBL16862492 0.84 CA1 (0.50) CA1CA2MAPTTDP1KDM4E
SCHEMBL19776121 0.84 CA1 (0.50) CA1CA2MAPTTDP1KDM4E
SCHEMBL31726507 0.84 CA1 (0.50) CA1CA2MAPTTDP1KDM4E
SCHEMBL16847607 0.84 MAPT (0.49) CA1CA2MAPTTDP1KDM4E
SCHEMBL21450347 0.84 CA2 (0.49) CA1CA2MAPTTDP1KDM4E
SCHEMBL31121268 0.82 CA1 (0.44) CA1CA2MAPTTDP1KDM4E
SCHEMBL14950097 0.82 SIRT5 (0.42) CA1CA2MAPTTDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10344261-B2 Immunomodulatory conjugates ASCEND BIOPHARMACEUTICALS LTD (AU) 2019-07-09 — — US disclosed
US-20150030626-A1 IMMUNOMODULATORY CONJUGATES Ascend Biopharamaceuticals Ltd (AU) 2015-01-29 — — 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 (2 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-10344261-B2 Immunomodulatory conjugates CLEC4M, TLR3, CD74 CA1 3928/4885CA2 4208/4885MAPT 2147/4885
US-20150030626-A1 IMMUNOMODULATORY CONJUGATES CLEC4M, TLR3, CD74 CA1 3928/4885CA2 4208/4885MAPT 2147/4885

“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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