SCHEMBL29897045

SCHEMBL29897045

CNC(=O)Cn1nc(C)c(-c2c(Cl)ccc3c2c(C)c(C(=O)OC)n3CCCOc2cc(SCc3ccc(OC)cc3)cc3ccccc23)c1CO

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 1/20 0.31
BCL2 P10415 1/20 0.30
BCL2L1 Q07817 1/20 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
SCHEMBL25254199 1.00 CYP2C8 (0.31) CYP2C8BCL2BCL2L1
SCHEMBL25248298 0.93 CYP2C8 (0.35) CYP2C8BCL2BCL2L1
SCHEMBL29897089 0.93 CYP2C8 (0.35) CYP2C8BCL2BCL2L1
SCHEMBL29897071 0.92 PDE6D (0.30) BCL2BCL2L1
SCHEMBL25249630 0.92 PDE6D (0.30) BCL2BCL2L1
SCHEMBL25295798 0.91 BAD (0.33) CYP2C8BCL2BCL2L1
SCHEMBL29897059 0.91 BAD (0.33) CYP2C8BCL2BCL2L1
SCHEMBL25786208 0.88 MARK3 (0.34) CYP2C8BCL2BCL2L1
SCHEMBL25290938 0.86 BAD (0.35) BCL2BCL2L1
SCHEMBL29897046 0.86 BAD (0.35) BCL2BCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11691989-B2 Macrocyclic indoles as Mcl-1 inhibitors ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) 2023-07-04 US disclosed
US-20220340595-A1 MACROCYCLIC INDOLES AS MCL-1 INHIBITORS ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) 2022-10-27 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 (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-20220340595-A1 MACROCYCLIC INDOLES AS MCL-1 INHIBITORS MCL1, BCL2A1, BCL2L1 CYP2C8 3462/4885BCL2 10/4885BCL2L1 3/4885
US-11691989-B2 Macrocyclic indoles as Mcl-1 inhibitors MCL1, BCL2A1, BCL2L1 CYP2C8 3462/4885BCL2 10/4885BCL2L1 3/4885

“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.