SCHEMBL25819728

SCHEMBL25819728

CNCCOCCn1cc(C)nn1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.35
NCF1 P14598 3/20 0.33
CHRNA7 P36544 2/20 0.32
MAPT P10636 1/20 0.32
GBA1 P04062 1/20 0.32
MAPK14 Q16539 3/20 0.31
DRD2 P14416 7/20 0.31
DRD4 P21917 4/20 0.31
DRD3 P35462 4/20 0.31
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
HTT P42858 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
SCHEMBL22906473 0.98 DPP4 (0.35) DPP4NCF1CHRNA7MAPTGBA1
SCHEMBL18850696 0.98 DPP4 (0.35) DPP4NCF1CHRNA7MAPTGBA1
SCHEMBL20180742 0.84 DPP4 (0.34) DPP4NCF1CHRNA7MAPTGBA1
SCHEMBL23560142 0.83 DRD2 (0.35) DPP4NCF1CHRNA7MAPTGBA1
SCHEMBL15976248 0.83 GBA1 (0.39) DPP4NCF1CHRNA7MAPTGBA1
SCHEMBL18685242 0.83 DPP4 (0.40) DPP4GBA1DRD2DRD4DRD3
SCHEMBL21106182 0.82 KDM4E (0.37) DPP4NCF1CHRNA7MAPK14POLB
SCHEMBL22856476 0.82 KDM4E (0.37) DPP4NCF1CHRNA7MAPK14POLB
SCHEMBL23806873 0.82 KDM4E (0.34) DPP4NCF1CHRNA7MAPK14DRD2
SCHEMBL22790885 0.82 NCF1 (0.33) DPP4NCF1CHRNA7MAPK14DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230220008-A1 MULTIMERIC BICYCLIC PEPTIDE LIGANDS BICYCLETX LIMITED (GB) 2023-07-13 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 (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-20230220008-A1 MULTIMERIC BICYCLIC PEPTIDE LIGANDS CD40, TNFSF11, TNFRSF9 DPP4 233/4885NCF1 2004/4885CHRNA7 1961/4885

“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.