SCHEMBL25974541

SCHEMBL25974541

COCC1CCNC(=O)C1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.37
PDCD1 Q15116 2/20 0.35
CD274 Q9NZQ7 2/20 0.35
KIT P10721 1/20 0.33
MAP2K1 Q02750 1/20 0.33
PRKACA P17612 1/20 0.32
PRKACG P22612 1/20 0.32
PRKACB P22694 1/20 0.32
MKNK2 Q9HBH9 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
OPRL1 P41146 1/20 0.31

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
SCHEMBL19045234 1.00 IRAK4 (0.37) IRAK4PDCD1CD274KITMAP2K1
SCHEMBL19045197 1.00 IRAK4 (0.37) IRAK4PDCD1CD274KITMAP2K1
SCHEMBL23176897 0.81 IRAK4 (0.36) IRAK4PDCD1CD274KITMKNK2
SCHEMBL14525341 0.81 IRAK4 (0.35) IRAK4PDCD1CD274
SCHEMBL21514172 0.81 IRAK4 (0.37) IRAK4PDCD1CD274MKNK2OPRL1
SCHEMBL25094275 0.80 IRAK4 (0.35) IRAK4PDCD1CD274KITOPRL1
SCHEMBL23278030 0.80 IRAK4 (0.42) IRAK4PDCD1CD274KIT
SCHEMBL23278033 0.80 IRAK4 (0.42) IRAK4PDCD1CD274KIT
SCHEMBL10196198 0.80
SCHEMBL10196068 0.80

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
US-11912708-B2 Macrocyclic heterocycles and uses thereof KUMQUAT BIOSCIENCES INC. (US) 2024-02-27 US disclosed
WO-2023205701-A1 MACROCYCLIC HETEROCYCLES AND USES THEREOF KUMQUAT BIOSCIENCES INC. (US) 2023-10-26 WO disclosed
WO-2023154282-A1 COMPOUNDS HAVING A T-STRUCTURE FORMED BY AT LEAST FOUR CYCLES FOR USE IN THE TREATMENT OF CANCER AND OTHER INDICATIONS THERAS, INC. (US) 2023-08-17 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-11912708-B2 Macrocyclic heterocycles and uses thereof HRAS, KRAS, TP53 IRAK4 2246/4885PDCD1 1497/4885CD274 3380/4885

“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.