SCHEMBL19615532

SCHEMBL19615532

CCOC(=O)c1[nH]c2c(-c3cc(O)cc(OC)c3)cccc2c1CCCOc1cccc2c1CCCC2

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 18/20 0.60
CDC7 O00311 1/20 0.41
MARK3 P27448 1/20 0.41
AXL P30530 1/20 0.41
FRK P42685 1/20 0.41
BLK P51451 1/20 0.41
NEK4 P51957 1/20 0.41
PRKCD Q05655 1/20 0.41
MAP4K2 Q12851 1/20 0.41
CAMK2B Q13554 1/20 0.41
CAMK2G Q13555 1/20 0.41
CAMK2D Q13557 1/20 0.41
CDC42BPA Q5VT25 1/20 0.41
MARK2 Q7KZI7 1/20 0.41
TAOK1 Q7L7X3 1/20 0.41
PIM3 Q86V86 1/20 0.41
MINK1 Q8N4C8 1/20 0.41
HIPK4 Q8NE63 1/20 0.41
BRSK1 Q8TDC3 1/20 0.41
AURKB Q96GD4 1/20 0.41

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
SCHEMBL19615313 0.86 MCL1 (0.60) MCL1CDC7MARK3AXLFRK
SCHEMBL21802270 0.83 MCL1 (0.41) MCL1CDC7MARK3AXLFRK
SCHEMBL4165525 0.81 MCL1 (0.64) MCL1CDC7MARK3AXLFRK
SCHEMBL4151868 0.79 MCL1 (0.62) MCL1CDC7MARK3AXLFRK
SCHEMBL2205708 0.78 MCL1 (0.79) MCL1BCL2
SCHEMBL29601882 0.77 MCL1 (0.59) MCL1CDC7MARK3AXLFRK
SCHEMBL19615197 0.77 MCL1 (0.59) MCL1CDC7MARK3AXLFRK
SCHEMBL24744663 0.76 MCL1 (0.58) MCL1MARK3NEK4PRKCDMAP4K2
SCHEMBL30000989 0.76 MCL1 (0.58) MCL1MARK3NEK4PRKCDMAP4K2
SCHEMBL15623065 0.76 MCL1 (0.75) MCL1BCL2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11492358-B1 Macrocyclic indole derivatives THE BROAD INSTITUTE, INC. (US) 2022-11-08 US disclosed
EP-3458459-B1 MACROCYCLIC INDOLE DERIVATIVES BAYER AG (DE) 2022-04-27 EP disclosed
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
EP-3458459-A1 MACROCYCLIC INDOLE DERIVATIVES Bayer Aktiengesellschaft (DE) 2019-03-27 EP disclosed
WO-2017198341-A1 MACROCYCLIC INDOLE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2017-11-23 WO 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 (3 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-11492358-B1 Macrocyclic indole derivatives CCND2, CCNT2, IDO1 MCL1 54/4885CDC7 1535/4885MARK3 2093/4885
US-10981932-B2 Macrocyclic indole derivatives CCND2, IDO1, CCNT2 MCL1 62/4885CDC7 1571/4885MARK3 1786/4885
US-20200087322-A1 MACROCYCLIC INDOLE DERIVATIVES CCND2, CCNA1, CCNT2 MCL1 56/4885CDC7 1581/4885MARK3 2126/4885

“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.