SCHEMBL23809256

SCHEMBL23809256

Cc1ccnc(-n2cnc(-c3ccc4c(c3)c(C(C)C)cn4C)n2)n1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.33
MCL1 Q07820 1/20 0.31
RIPK1 Q13546 3/20 0.30

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
SCHEMBL23809239 0.88 MEN1 (0.36) MCL1RIPK1
SCHEMBL26581706 0.87 MCL1 (0.33) IRAK4MCL1
SCHEMBL20605065 0.85 HASPIN (0.37) IRAK4MCL1
SCHEMBL23809465 0.79 MTNR1A (0.37) MCL1RIPK1
SCHEMBL23809296 0.79 GRM5 (0.47) IRAK4MCL1RIPK1
SCHEMBL23809218 0.78 DRD2 (0.42) MCL1
SCHEMBL23799645 0.78 HSD11B1 (0.41)
SCHEMBL26581668 0.75 MCL1 (0.39) MCL1RIPK1
SCHEMBL23809246 0.74 MEN1 (0.43) RIPK1
SCHEMBL23809238 0.73 HSD17B2 (0.34) MCL1RIPK1

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-20210283138-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2021-09-16 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-20210283138-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 IRAK4 1956/4885MCL1 1/4885RIPK1 560/4885

“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.