SCHEMBL28901062

SCHEMBL28901062

[N-]=[N+]=NCC(=O)NCCN

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
ALDH1A1 P00352 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CYP1A2 P05177 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
MAOB P27338 1/20 0.31
MEN1 O00255 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL20829940 0.89 CA2 (0.48) CA2CA9ALDH1A1MEN1KMT2A
SCHEMBL28099596 0.87 CA2 (0.47) CA2CA9ALDH1A1MAOBMEN1
SCHEMBL15057676 0.85 PAOX (0.47) CA2CA9ALDH1A1MAOBMEN1
SCHEMBL13887521 0.82 CA2 (0.48) CA2CA9ALDH1A1MEN1KMT2A
SCHEMBL21981211 0.82 CA2 (0.48) CA2CA9ALDH1A1MEN1BLM
SCHEMBL22688014 0.80 CA2 (0.45) CA2CA9
SCHEMBL23568300 0.80 CA2 (0.42) CA2CA9CYP2C19TSHR
SCHEMBL16014560 0.80 CA2 (0.47) CA2CA9ALDH1A1MEN1KMT2A
SCHEMBL28480824 0.78 CA2 (0.46) CA2CA9ALDH1A1MEN1KMT2A
SCHEMBL18063509 0.78 SLC6A5 (0.38) CA2CA9TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111920959-B ROS (reactive oxygen species) -responsive heparin polysaccharide nano prodrug compound based on click reaction, nano preparation, and preparation method and application thereof 中国药科大学 2022-03-25 CN claimed
CN-111920959-A ROS (reactive oxygen species) -responsive heparin polysaccharide nano prodrug compound based on click reaction, nano preparation, and preparation method and application thereof 中国药科大学 2020-11-13 CN claimed
US-12629458-B2 Agent to be used in intraocular membrane detachment surgery FUKUOKA UNIVERSITY (JP) 2026-05-19 US disclosed
CN-118403227-A Formulations for use in intraocular lens stripping 学校法人福冈大学 2024-07-30 CN disclosed
CN-115209926-B Formulations for use in intraocular lens stripping 学校法人福冈大学 2024-05-14 CN disclosed
US-20230136938-A1 AGENT TO BE USED IN INTRAOCULAR MEMBRANE DETACHMENT SURGERY FUKUOKA UNIVERSITY (JP) 2023-05-04 US disclosed
EP-4129353-A1 AGENT TO BE USED IN INTRAOCULAR MEMBRANE DETACHMENT SURGERY Fukuoka University (JP) 2023-02-08 EP disclosed
CN-111920959-B ROS (reactive oxygen species) -responsive heparin polysaccharide nano prodrug compound based on click reaction, nano preparation, and preparation method and application thereof 中国药科大学 2022-03-25 CN disclosed
CN-111920959-A ROS (reactive oxygen species) -responsive heparin polysaccharide nano prodrug compound based on click reaction, nano preparation, and preparation method and application thereof 中国药科大学 2020-11-13 CN 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-12629458-B2 Agent to be used in intraocular membrane detachment surgery VIM, VEGFA, MKI67 CA2 982/4885CA9 192/4885ALDH1A1 2647/4885

“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.