SCHEMBL16424832

SCHEMBL16424832

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT5 Q9NXA8 2/20 0.43
▸ CA1 P00915 3/20 0.43
▸ CA2 P00918 3/20 0.43
▸ MAPT P10636 3/20 0.40
▸ TDP1 Q9NUW8 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ GLA P06280 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ PAX8 Q06710 1/20 0.40
▸ PSEN1 P49768 2/20 0.39
▸ PSEN2 P49810 2/20 0.39
▸ APH1B Q8WW43 2/20 0.39
▸ NCSTN Q92542 2/20 0.39
▸ APH1A Q96BI3 2/20 0.39
▸ PSENEN Q9NZ42 2/20 0.39
▸ MMP1 P03956 1/20 0.39
▸ MMP3 P08254 1/20 0.39
▸ MMP9 P14780 1/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.38
▸ SIRT2 Q8IXJ6 5/20 0.38

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
SCHEMBL21163027 0.95 CA1 (0.43) SIRT5CA1CA2MAPTTDP1
SCHEMBL14950097 0.89 SIRT5 (0.42) SIRT5CA1CA2MAPTTDP1
SCHEMBL27410339 0.89 CA1 (0.51) SIRT5CA1CA2MAPTTDP1
SCHEMBL24297227 0.82 CA2 (0.41) SIRT5CA1CA2MAPTTDP1
SCHEMBL29078274 0.82 CA2 (0.41) SIRT5CA1CA2MAPTTDP1
SCHEMBL29335201 0.82 CA1 (0.45) SIRT5CA1CA2MAPTTDP1
SCHEMBL27410343 0.82 CA1 (0.53) SIRT5CA1CA2MAPTTDP1
SCHEMBL31045343 0.82 SIRT2 (0.56) SIRT5MAPTSIRT2SIRT1SIRT3
SCHEMBL21450348 0.81 CA1 (0.38) SIRT5CA1CA2MAPTTDP1
SCHEMBL25401869 0.81 CA1 (0.38) SIRT5CA1CA2MAPTTDP1

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 SIRT5 663/4885CA1 3928/4885CA2 4208/4885
US-20150030626-A1 IMMUNOMODULATORY CONJUGATES CLEC4M, TLR3, CD74 SIRT5 663/4885CA1 3928/4885CA2 4208/4885

“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.

Send feedback