SCHEMBL25453370

SCHEMBL25453370

Cc1cc(N)c(C(=O)N2CCOC(c3ccccc3)C2)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SPR P35270 2/20 0.44
CNR2 P34972 2/20 0.42
USP30 Q70CQ3 2/20 0.42
PDE2A O00408 6/20 0.40
KRAS P01116 3/20 0.37
RIPK1 Q13546 1/20 0.37
P2RX7 Q99572 1/20 0.37

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
SCHEMBL25453738 1.00 SPR (0.44) SPRCNR2USP30PDE2AKRAS
SCHEMBL23901500 0.89 SPR (0.54) SPRCNR2USP30
SCHEMBL23901474 0.85 SPR (0.48) SPRCNR2USP30PDE2AKRAS
SCHEMBL23901483 0.77 USP30 (0.45) SPRCNR2USP30KRASP2RX7
SCHEMBL14413642 0.73 USP30 (0.54) CNR2USP30PDE2ARIPK1
SCHEMBL1710753 0.73 USP30 (0.50) USP30PDE2A
SCHEMBL25454990 0.72 GLRA1 (0.46) SPR
SCHEMBL25453440 0.72 USP30 (0.54) CNR2USP30PDE2ARIPK1
SCHEMBL19049384 0.72 USP30 (0.54) CNR2USP30PDE2ARIPK1
SCHEMBL25455849 0.72 SPR (0.39) SPRCNR2USP30KRASP2RX7

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-20230143470-A1 SMALL MOLECULE INHIBITORS OF INFLUENZA HEMAGGLUTININ NATIONAL INSTITUTES OF HEALTH 2023-05-11 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-20230143470-A1 SMALL MOLECULE INHIBITORS OF INFLUENZA HEMAGGLUTININ HAVCR2, CD44, ENGASE SPR 931/4885CNR2 4767/4885USP30 545/4885

“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.