SCHEMBL19635784

SCHEMBL19635784

CCOC(=O)c1c(CCCOc2cccc3ccccc23)c2cccc(-c3c(COc4ccc(N5CCN(S(C)(=O)=O)CC5)cc4)nn(C)c3CBr)c2n1CCCN(C)C(=O)OC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 20/20 0.57
BCL2 P10415 1/20 0.53
ALB P02768 2/20 0.40
PMAIP1 Q13794 2/20 0.38

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
SCHEMBL19634861 0.96 MCL1 (0.59) MCL1BCL2ALBPMAIP1
SCHEMBL19635780 0.95 MCL1 (0.58) MCL1BCL2ALBPMAIP1
SCHEMBL28646983 0.94 MCL1 (0.64) MCL1BCL2ALBPMAIP1
SCHEMBL19615431 0.93 MCL1 (0.62) MCL1BCL2ALBPMAIP1
SCHEMBL21802263 0.92 MCL1 (0.62) MCL1BCL2ALBPMAIP1
SCHEMBL30035990 0.92 MCL1 (0.62) MCL1BCL2ALBPMAIP1
SCHEMBL19615238 0.91 MCL1 (0.60) MCL1BCL2ALBPMAIP1
SCHEMBL19615174 0.91 MCL1 (0.49) MCL1BCL2ALBPMAIP1
SCHEMBL19616057 0.90 MCL1 (0.51) MCL1BCL2ALBPMAIP1
SCHEMBL28645771 0.90 MCL1 (0.65) MCL1BCL2ALBPMAIP1

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 6 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
CN-109715632-B Macrocyclic indole derivatives 拜尔公开股份有限公司 2021-10-26 CN disclosed
US-10981932-B2 Macrocyclic indole derivatives BAYER AKTIENGESELLSCHAFT (DE) 2021-04-20 US disclosed
US-10981932-B2 Macrocyclic indole derivatives BAYER AKTIENGESELLSCHAFT (DE) 2021-04-20 US disclosed
US-20200087322-A1 MACROCYCLIC INDOLE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-03-19 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 (2 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 62/4885BCL2 701/4885ALB 2042/4885
US-20200087322-A1 MACROCYCLIC INDOLE DERIVATIVES CCND2, CCNA1, CCNT2 MCL1 56/4885BCL2 741/4885ALB 3051/4885

“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.