SCHEMBL24952901

SCHEMBL24952901

CCN(C[C@H](C)O)C(=O)Nc1ncc(Oc2cccc(Cl)c2)s1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.41
▸ LMNA P02545 1/20 0.39
▸ GCK P35557 2/20 0.37
▸ CCNE1 P24864 1/20 0.36
▸ CDK2 P24941 1/20 0.36
▸ CDK5 Q00535 1/20 0.36
▸ CSNK2A2 P19784 1/20 0.36
▸ CSNK2A1 P68400 1/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CYP1A2 P05177 1/20 0.35

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
SCHEMBL24953890 0.89 CCNE1 (0.46) MAPTCCNE1CDK2CDK5CSNK2A2
SCHEMBL24952910 0.86 SCD (0.42) MAPTKMT2AL3MBTL1
SCHEMBL24953564 0.86 JAK2 (0.39) GCK
SCHEMBL24954289 0.85 RAB9A (0.39) MAPTLMNAGCKCCNE1CDK2
SCHEMBL24953934 0.85 CCNE1 (0.38) MAPTCCNE1CDK2CDK5
SCHEMBL24952962 0.83 GCK (0.44) GCKCCNE1CDK2CDK5
SCHEMBL24953737 0.83 GCK (0.44) GCKCCNE1CDK2CDK5
SCHEMBL24953935 0.83 GCK (0.37) GCKCCNE1CDK2CDK5
SCHEMBL24953916 0.82 PSEN1 (0.40) GCK
SCHEMBL24952914 0.82 ACACB (0.34) GCKCCNE1CDK2CDK5

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-20230029266-A1 MrgprX2 Antagonists for the Treatment of Inflammatory Disorders DERMIRA, INC. 2023-01-26 — — 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-20230029266-A1 MrgprX2 Antagonists for the Treatment of Inflammatory Disorders MRGPRX2, MRGPRX1, MRGPRX4 MAPT 3161/4885LMNA 4081/4885GCK 1519/4885

“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.

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