SCHEMBL19634948

SCHEMBL19634948

CCOC(=O)c1c(CCCOc2cccc3ccccc23)c2cccc(-c3c(CBr)nn(C)c3C(C)C)c2n1CCCNC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 20/20 0.49
ALB P02768 2/20 0.47
PMAIP1 Q13794 3/20 0.41
BCL2L1 Q07817 1/20 0.41
BAD Q92934 1/20 0.41
EEF2K O00418 1/20 0.39
MARK3 P27448 1/20 0.39
AXL P30530 1/20 0.39
BCL6 P41182 1/20 0.39
NEK4 P51957 1/20 0.39
PRKCD Q05655 1/20 0.39
PRKAA1 Q13131 1/20 0.39
CAMK2B Q13554 1/20 0.39
CAMK2G Q13555 1/20 0.39
CAMK2D Q13557 1/20 0.39
MARK2 Q7KZI7 1/20 0.39
PIM3 Q86V86 1/20 0.39
HIPK2 Q9H2X6 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
MAP3K20 Q9NYL2 1/20 0.39

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
Hydrochloric Acid SCHEMBL19615419 0.99 MCL1 (0.49) MCL1ALBPMAIP1BCL2L1BAD
Hydrochloric Acid SCHEMBL29601863 0.99 MCL1 (0.49) MCL1ALBPMAIP1BCL2L1BAD
SCHEMBL19634865 0.92 MCL1 (0.53) MCL1ALBPMAIP1BCL2L1BAD
Hydrochloric Acid SCHEMBL29602481 0.92 MCL1 (0.53) MCL1ALBPMAIP1BCL2L1BAD
Hydrochloric Acid SCHEMBL19615390 0.92 MCL1 (0.53) MCL1ALBPMAIP1BCL2L1BAD
SCHEMBL19635480 0.91 MCL1 (0.60) MCL1ALBPMAIP1BCL2L1BAD
Hydrochloric Acid SCHEMBL29601770 0.91 MCL1 (0.59) MCL1ALBPMAIP1BCL2L1BAD
Hydrochloric Acid SCHEMBL19615290 0.91 MCL1 (0.59) MCL1ALBPMAIP1BCL2L1BAD
SCHEMBL19635873 0.90 MCL1 (0.53) MCL1ALBPMAIP1BCL2L1BAD
Hydrochloric Acid SCHEMBL19615873 0.90 MCL1 (0.52) MCL1ALBPMAIP1BCL2L1BAD

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 62/4885ALB 2042/4885PMAIP1 1664/4885

“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.