SCHEMBL20264341

SCHEMBL20264341

CC(C)(C)OC(=O)N[C@H]1CSc2cnc(C(=O)O)cc2NC1=O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.40
▸ EPHX2 P34913 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ NFKB2 Q00653 1/20 0.34
▸ RELA Q04206 1/20 0.34
▸ CKS1B P61024 1/20 0.33
▸ SKP1 P63208 1/20 0.33
▸ SKP2 Q13309 1/20 0.33
▸ IDO1 P14902 1/20 0.32
▸ CTSD P07339 4/20 0.32
▸ BACE1 P56817 3/20 0.32
▸ DDB1 Q16531 3/20 0.32
▸ CRBN Q96SW2 3/20 0.32
▸ JAK1 P23458 3/20 0.31
▸ CCKAR P32238 1/20 0.31
▸ CCKBR P32239 1/20 0.31

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
SCHEMBL20287567 0.91 GAA (0.39) GAAEPHX2NFKB1NFKB2RELA
SCHEMBL25760377 0.88 GAA (0.41) GAAEPHX2NFKB1NFKB2RELA
SCHEMBL25766051 0.87 GAA (0.40) GAAEPHX2NFKB1NFKB2RELA
SCHEMBL25759562 0.82 GAA (0.42) GAAEPHX2NFKB1NFKB2RELA
SCHEMBL26961952 0.81 GAA (0.41) GAAEPHX2NFKB1NFKB2RELA
SCHEMBL20264133 0.81 SMN1; SMN2 (0.48) GAAEPHX2NFKB1NFKB2RELA
SCHEMBL26962099 0.81 GAA (0.44) GAAEPHX2NFKB1NFKB2RELA
SCHEMBL20263891 0.80 GAA (0.40) GAAEPHX2NFKB1NFKB2RELA
SCHEMBL20263999 0.80 GAA (0.40) GAAEPHX2NFKB1NFKB2RELA
SCHEMBL26962143 0.80 GAA (0.40) GAAEPHX2NFKB1NFKB2RELA

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-10472341-B2 Bicyclic tetrahydrothiazepine derivatives useful for the treatment of neoplastic and/or infectious diseases APEIRON BIOLOGICS AG (AT) 2019-11-12 — — US disclosed
US-20180170888-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES USEFUL FOR THE TREATMENT OF NEOPLASTIC AND/OR INFECTIOUS DISEASES APEIRON BIOLOGICS GMBH (AT) 2018-06-21 — — 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-10472341-B2 Bicyclic tetrahydrothiazepine derivatives useful for the treatment of neoplastic and/or infectious diseases CCNT2, HRH4, HRH3 GAA 3737/4885EPHX2 1697/4885NFKB1 2445/4885
US-20180170888-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES USEFUL FOR THE TREATMENT OF NEOPLASTIC AND/OR INFECTIOUS DISEASES CCNT2, HRH4, HRH3 GAA 3737/4885EPHX2 1697/4885NFKB1 2445/4885

“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