SCHEMBL23296155

SCHEMBL23296155

O=C(O)NCc1cn(-c2ccc(-n3ccc(=O)[nH]c3=O)cc2)nn1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MIF P14174 8/20 0.49
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
CA9 Q16790 3/20 0.48
CA4 P22748 2/20 0.48
NOTUM Q6P988 1/20 0.44
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
PTGS2 P35354 1/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
CA12 O43570 1/20 0.41

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
SCHEMBL23296124 0.84 CA1 (0.51) MIFCA1CA2CA9CA4
SCHEMBL23329310 0.84 CA1 (0.63) MIFCA1CA2CA9CA4
SCHEMBL3091122 0.82 MIF (0.53) MIFCA1CA2CA9CA4
SCHEMBL23296174 0.82 MIF (0.48) MIFCA1CA2CA9CA4
SCHEMBL23296182 0.82 NOTUM (0.53) MIFCA1CA2CA9CA4
SCHEMBL23296125 0.80 CA1 (0.57) CA1CA2CA9CA4NOTUM
SCHEMBL23296178 0.80 NOTUM (0.52) MIFCA1CA2CA9CA4
SCHEMBL23329343 0.76 NOTUM (0.47) MIFCA1CA2CA9CA4
SCHEMBL23296111 0.73 NOTUM (0.44) MIFCA1CA2CA9CA4
SCHEMBL16347647 0.71 MIF (0.50) MIFCA1CA2CA9NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11214564-B2 Compounds with thymine skeleton for use in medicine Technische Universität Dresden (DE) 2022-01-04 US disclosed
EP-3819006-A1 COMPOUNDS WITH THYMINE SKELETON FOR USE IN MEDICINE Technische Universität Dresden (DE) 2021-05-12 EP disclosed
US-20210130328-A1 NOVEL COMPOUNDS WITH THYMINE SKELETON FOR USE IN MEDICINE Technische Universität Dresden (DE) 2021-05-06 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-20210130328-A1 NOVEL COMPOUNDS WITH THYMINE SKELETON FOR USE IN MEDICINE TMSB10, TMSB4X, TBCA MIF 1173/4885CA1 4427/4885CA2 4260/4885
US-11214564-B2 Compounds with thymine skeleton for use in medicine TMSB10, TMSB4X, TBCA MIF 1468/4885CA1 4117/4885CA2 3933/4885

“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.