SCHEMBL19634871

SCHEMBL19634871

CCOC(=O)c1c(CCCOc2cccc3ccccc23)c2cccc3c2n1CCCCCCc1c-3c(COc2ccc(N3CCN(C(=O)OC(C)(C)C)CC3)cc2)nn1C

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 20/20 0.52
PMAIP1 Q13794 6/20 0.45
BCL2 P10415 1/20 0.44
BCL2L1 Q07817 1/20 0.44
BAD Q92934 1/20 0.44

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
SCHEMBL21802265 0.94 MCL1 (0.57) MCL1PMAIP1BCL2BCL2L1BAD
SCHEMBL19635367 0.93 MCL1 (0.56) MCL1BCL2BCL2L1BAD
SCHEMBL19635264 0.90 MCL1 (0.63) MCL1PMAIP1BCL2BCL2L1BAD
SCHEMBL19635395 0.88 MCL1 (0.52) MCL1PMAIP1BCL2BCL2L1BAD
SCHEMBL19615978 0.88 MCL1 (0.56) MCL1BCL2BCL2L1BAD
SCHEMBL19635379 0.88 MCL1 (0.58) MCL1PMAIP1BCL2BCL2L1BAD
SCHEMBL19615216 0.86 MCL1 (0.61) MCL1BCL2BCL2L1BAD
SCHEMBL23251221 0.86 MCL1 (0.44) MCL1PMAIP1BCL2L1BAD
SCHEMBL19635054 0.85 MCL1 (0.60) MCL1BCL2BCL2L1BAD
SCHEMBL19635051 0.84 MCL1 (0.60) MCL1BCL2BCL2L1BAD

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
EP-3458459-B1 MACROCYCLIC INDOLE DERIVATIVES BAYER AG (DE) 2022-04-27 EP disclosed
US-10981932-B2 Macrocyclic indole derivatives BAYER AKTIENGESELLSCHAFT (DE) 2021-04-20 US disclosed
WO-2017198341-A1 MACROCYCLIC INDOLE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2017-11-23 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-10981932-B2 Macrocyclic indole derivatives CCND2, IDO1, CCNT2 MCL1 62/4885PMAIP1 1664/4885BCL2 701/4885

“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.