SCHEMBL23786184

SCHEMBL23786184

NCCOCCNC(=O)CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 2/20 0.47
KMT2A Q03164 3/20 0.46
POLB P06746 3/20 0.45
LMNA P02545 2/20 0.45
KAT2B Q92831 2/20 0.41
HCAR3 P49019 1/20 0.41
PKM P14618 2/20 0.40
MEN1 O00255 2/20 0.40
MAPK1 P28482 2/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL3791900 0.99 MAPT (0.47) MAPTKDM4EALDH1A1KMT2APOLB
SCHEMBL3791891 0.88 MAPT (0.45) MAPTKDM4EALDH1A1KMT2APOLB
SCHEMBL23786318 0.86 MAPT (0.47) MAPTKDM4EALDH1A1KMT2APOLB
SCHEMBL23705193 0.85 KMT2A (0.55) MAPTKDM4EALDH1A1KMT2APOLB
SCHEMBL21113593 0.85 KMT2A (0.55) MAPTKDM4EALDH1A1KMT2APOLB
SCHEMBL28845231 0.85 KMT2A (0.55) MAPTKDM4EALDH1A1KMT2APOLB
SCHEMBL23786301 0.82 ALDH1A1 (0.48) MAPTKDM4EALDH1A1KMT2APOLB
SCHEMBL20402644 0.79 MAPT (0.57) MAPTKDM4EALDH1A1KMT2APOLB
SCHEMBL23705089 0.79 MAPT (0.57) MAPTKDM4EALDH1A1KMT2APOLB
SCHEMBL21531212 0.79 MAPT (0.52) MAPTKDM4EALDH1A1KMT2APOLB

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-11827624-B2 Covalent immune recruiter compounds for immune cell recognition and associated uses MCMASTER UNIVERSITY (CA) 2023-11-28 US disclosed
US-11827624-B2 Covalent immune recruiter compounds for immune cell recognition and associated uses MCMASTER UNIVERSITY (CA) 2023-11-28 US disclosed
US-20210276981-A1 COVALENT IMMUNE RECRUITER COMPOUNDS FOR IMMUNE CELL RECOGNITION AND ASSOCIATED USES MCMASTER UNIVERSITY (CA) 2021-09-09 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-11827624-B2 Covalent immune recruiter compounds for immune cell recognition and associated uses CD74, CD4, HLA-A MAPT 875/4885KDM4E 3145/4885ALDH1A1 396/4885
US-20210276981-A1 COVALENT IMMUNE RECRUITER COMPOUNDS FOR IMMUNE CELL RECOGNITION AND ASSOCIATED USES CD74, CD4, HLA-A MAPT 1211/4885KDM4E 3686/4885ALDH1A1 163/4885

“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.