SCHEMBL20880632

SCHEMBL20880632

CC(=O)NCC(=O)NCC(N)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.38
KDM4E B2RXH2 1/20 0.37
MAPK1 P28482 1/20 0.37
HIF1A Q16665 1/20 0.37
PAOX Q6QHF9 3/20 0.35
CRBN Q96SW2 1/20 0.35
TSHR P16473 1/20 0.34
ALDH1A1 P00352 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TAS2R38 P59533 1/20 0.32
LMNA P02545 1/20 0.32
ALOX15 P16050 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
RECQL P46063 1/20 0.31
MTNR1A P48039 3/20 0.31
MTNR1B P49286 3/20 0.31
MAOA P21397 2/20 0.30
MAOB P27338 2/20 0.30
ADRA1A P35348 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
SCHEMBL292864 0.90
Hydrochloric Acid SCHEMBL6045193 0.87
Bromide SCHEMBL5490789 0.87
SCHEMBL22199552 0.81 CA1 (0.40) RECQLMAOAMAOB
SCHEMBL22339735 0.81 MEN1 (0.46) RECQLMAOAMAOB
Acetic Acid SCHEMBL10662111 0.80 TERT (0.36) MAOAMAOB
Acetic Acid SCHEMBL10659181 0.80 TERT (0.36) MAOAMAOB
SCHEMBL12661037 0.80 KDM4E (0.40) F2KDM4EMAPK1HIF1APAOX
SCHEMBL21689227 0.80 F2 (0.36) F2KDM4EMAPK1HIF1ACRBN
SCHEMBL31047740 0.80 SOST (0.36) KDM4EPAOXALDH1A1LMNAALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3777876-B1 N-ACYLDIPEPTIDE DERIVATIVES AND THEIR USES NEOSTRATA COMPANY INC (US) 2023-08-09 EP disclosed
WO-2020245843-A1 CHEMOSELECTIVE SENSITIVITY BOOSTER FOR TAGGING A PEPTIDE, PEPTIDE CONJUGATE, OR SIMILAR REACTIVE MOLECULE Indian Institute Of Science Education And Research Bhopal (IN) 2020-12-10 WO disclosed
US-20200031862-A1 LIGAND-MODIFIED DOUBLE-STRANDED NUCLEIC ACIDS DICERNA PHARMACEUTICALS, INC. 2020-01-30 US disclosed
EP-3466976-A1 ANTI-HER2 ANTIBODY-DRUG CONJUGATE Daiichi Sankyo Company, Limited (JP) 2019-04-10 EP 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-20200031862-A1 LIGAND-MODIFIED DOUBLE-STRANDED NUCLEIC ACIDS ADAR, NCL, SSU72 F2 4471/4885KDM4E 4665/4885MAPK1 4492/4885

“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.