SCHEMBL22906161

SCHEMBL22906161

CC(=O)NCc1cn(C(C)C)nn1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.49
NPSR1 Q6W5P4 1/20 0.45
ALOX15 P16050 1/20 0.43
ANPEP P15144 1/20 0.39
PARP14 Q460N5 1/20 0.38
SETDB1 Q15047 1/20 0.36

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
SCHEMBL19655507 0.86 ANPEP (0.41) ANPEP
SCHEMBL20997046 0.84 PARP14 (0.41) NOTUMANPEPPARP14
SCHEMBL24334472 0.83 ANPEP (0.40) ANPEPPARP14
SCHEMBL24256389 0.78 NOTUM (0.47) NOTUMNPSR1ALOX15ANPEP
SCHEMBL16579400 0.78 NOTUM (0.52) NOTUMNPSR1ALOX15SETDB1
SCHEMBL27048554 0.78 CCNE1 (0.35)
SCHEMBL22917093 0.78 PARP14 (0.46) NPSR1ANPEPPARP14
SCHEMBL24968449 0.78 NOTUM (0.44) NOTUMNPSR1ALOX15PARP14
SCHEMBL14262407 0.78 CYP19A1 (0.36) ANPEP
SCHEMBL26318734 0.77 NOTUM (0.46) NOTUMNPSR1ALOX15SETDB1

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
WO-2022272133-A2 PROTEIN STABILIZING COMPOUNDS CONTAINING USP7 LIGANDS Stablix, Inc. (US) 2022-12-29 WO disclosed
US-20220118120-A1 CANCER DIAGNOSTIC IMAGING AGENTS Technische Universität München (DE) 2022-04-21 US disclosed
WO-2020006423-A9 SYNTHETIC GUIDE MOLECULES, COMPOSITIONS AND METHODS RELATING THERETO EDITAS MEDICINE, INC. (US) 2021-01-21 WO 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-20220118120-A1 CANCER DIAGNOSTIC IMAGING AGENTS FOLH1, FOLR1, KLK3 NOTUM 4501/4885NPSR1 865/4885ALOX15 4876/4885

“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.