SCHEMBL23296154

SCHEMBL23296154

O=c1ccn(-c2cccc([N+](=O)[O-])c2)c(=O)[nH]1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.57
CRBN Q96SW2 1/20 0.57
POLB P06746 2/20 0.55
ALDH1A1 P00352 2/20 0.55
HPN P05981 1/20 0.54
SCN2A Q99250 1/20 0.51
PGR P06401 1/20 0.49
FGFR1 P11362 1/20 0.49
LMNA P02545 1/20 0.48
TSHR P16473 1/20 0.48
MEN1 O00255 3/20 0.48
MAPT P10636 3/20 0.48
KMT2A Q03164 3/20 0.48
KDM4E B2RXH2 1/20 0.48
NPC1 O15118 1/20 0.46
GAA P10253 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL3370902 0.82 CRBN (0.58) DDB1CRBNPOLBALDH1A1SCN2A
SCHEMBL5846757 0.80 HPN (0.49) POLBALDH1A1HPNSCN2APGR
SCHEMBL3586307 0.77 MAPT (0.56) POLBALDH1A1HPNSCN2AFGFR1
SCHEMBL5328812 0.76 HPN (0.58) POLBALDH1A1HPNSCN2ALMNA
SCHEMBL6303330 0.74 FGFR1 (0.58) POLBALDH1A1HPNSCN2AFGFR1
SCHEMBL29824590 0.74 FGFR1 (0.58) POLBALDH1A1HPNSCN2AFGFR1
SCHEMBL1530734 0.74 CRBN (1.00) DDB1CRBNGAA
SCHEMBL23296167 0.73 CRBN (0.65) DDB1CRBNALDH1A1MEN1MAPT
SCHEMBL22572762 0.73 CRBN (0.65) DDB1CRBNALDH1A1LMNAMAPT
SCHEMBL14685529 0.73 CRBN (0.65) DDB1CRBNALDH1A1MAPTKMT2A

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 5 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
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
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 DDB1 749/4885CRBN 4631/4885POLB 3211/4885
US-11214564-B2 Compounds with thymine skeleton for use in medicine TMSB10, TMSB4X, TBCA DDB1 634/4885CRBN 4580/4885POLB 3391/4885

“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.