SCHEMBL19662980

SCHEMBL19662980

CCn1cc(CNC(C)=O)nn1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.50
NPSR1 Q6W5P4 1/20 0.46
ALOX15 P16050 1/20 0.44
GBA1 P04062 6/20 0.39

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
SCHEMBL25884344 0.89 NOTUM (0.49) NOTUMNPSR1ALOX15GBA1
SCHEMBL17369045 0.85 GLS (0.45) GBA1
SCHEMBL7963203 0.85 NOTUM (0.49) NOTUMNPSR1ALOX15
SCHEMBL24812463 0.84 GBA1 (0.53) NOTUMGBA1
SCHEMBL23011813 0.84 GBA1 (0.41) GBA1
SCHEMBL25882774 0.83 NOTUM (0.47) NOTUMNPSR1ALOX15GBA1
SCHEMBL24256389 0.83 NOTUM (0.47) NOTUMNPSR1ALOX15
SCHEMBL29324043 0.80 NOTUM (0.45) NOTUMNPSR1ALOX15GBA1
SCHEMBL23518630 0.80 GBA1 (0.43) NOTUMGBA1
SCHEMBL16579400 0.79 NOTUM (0.52) NOTUMNPSR1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230346951-A1 MOLECULAR DEGRADERS OF EXTRACELLULAR PROTEINS YALE UNIVERSITY 2023-11-02 US disclosed
US-20170340746-A1 PEGYLATED CARFILZOMIB COMPOUNDS AMGEN INC. 2017-11-30 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-20170340746-A1 PEGYLATED CARFILZOMIB COMPOUNDS MCL1, FCGRT, MAN2B1 NOTUM 3532/4885NPSR1 1405/4885ALOX15 1615/4885
US-20230346951-A1 MOLECULAR DEGRADERS OF EXTRACELLULAR PROTEINS ASGR1, MSR1, LDLR NOTUM 2312/4885NPSR1 171/4885ALOX15 1477/4885

“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.