SCHEMBL29335201

SCHEMBL29335201

CC(C)[C@H](NC(=O)CN1C(=O)C=CC1=O)C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)Nc1ccc(CO)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 3/20 0.45
▸ CA2 P00918 3/20 0.45
▸ SIRT5 Q9NXA8 1/20 0.42
▸ MAPT P10636 4/20 0.40
▸ TDP1 Q9NUW8 4/20 0.40
▸ KDM4E B2RXH2 3/20 0.40
▸ GLA P06280 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ PAX8 Q06710 1/20 0.40
▸ AKT1 P31749 1/20 0.39
▸ NPSR1 Q6W5P4 3/20 0.38
▸ HDAC4 P56524 2/20 0.38
▸ HDAC1 Q13547 2/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MMP1 P03956 1/20 0.38
▸ MMP3 P08254 1/20 0.38
▸ MMP9 P14780 1/20 0.38
▸ HDAC3 O15379 1/20 0.37
▸ HDAC7 Q8WUI4 1/20 0.37
▸ HDAC2 Q92769 1/20 0.37

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
SCHEMBL31045340 0.90 CA1 (0.41) CA1CA2SIRT5MAPTTDP1
SCHEMBL21450348 0.86 CA1 (0.38) CA1CA2SIRT5MAPTTDP1
SCHEMBL25401869 0.86 CA1 (0.38) CA1CA2SIRT5MAPTTDP1
SCHEMBL29335489 0.85 ACE (0.44) CA1CA2SIRT5MAPTTDP1
SCHEMBL21163027 0.83 CA1 (0.43) CA1CA2SIRT5MAPTTDP1
SCHEMBL16424832 0.82 SIRT5 (0.43) CA1CA2SIRT5MAPTTDP1
SCHEMBL31045343 0.81 SIRT2 (0.56) SIRT5MAPTSIRT2SIRT1SIRT3
SCHEMBL19681322 0.81 SIRT2 (0.40) SIRT5SIRT2SIRT1SIRT3
SCHEMBL16424839 0.81 CA1 (0.52) CA1CA2SIRT5MAPTTDP1
SCHEMBL21477708 0.80 SIRT2 (0.40) SIRT5SIRT2SIRT1SIRT3

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-20240238440-A1 PREPARATION METHOD FOR AND APPLICATION OF ANTIBODY CONJUGATED DRUG HYSLINK THERAPEUTICS (CN) 2024-07-18 — — 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-20240238440-A1 PREPARATION METHOD FOR AND APPLICATION OF ANTIBODY CONJUGATED DRUG SI, MET, MTX1 CA1 95/4885CA2 1493/4885SIRT5 2463/4885

“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