SCHEMBL22993271

SCHEMBL22993271

COC(=O)[C@H](CC(=O)O)c1ccc2c(c1)N(CC1CCC1)C[C@@]1(CCCc3cc(Cl)ccc31)CO2

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 20/20 0.74
BCL2L11 O43521 14/20 0.51

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
SCHEMBL22993281 1.00 MCL1 (0.74) MCL1BCL2L11
SCHEMBL29436725 0.93 MCL1 (0.70) MCL1BCL2L11
SCHEMBL29436641 0.93 MCL1 (0.70) MCL1BCL2L11
SCHEMBL22992852 0.92 MCL1 (0.69) MCL1BCL2L11
SCHEMBL29436419 0.92 MCL1 (0.69) MCL1BCL2L11
SCHEMBL22992853 0.92 MCL1 (0.69) MCL1BCL2L11
SCHEMBL29436540 0.92 MCL1 (0.69) MCL1BCL2L11
SCHEMBL22975862 0.92 MCL1 (0.82) MCL1BCL2L11
SCHEMBL22975773 0.92 MCL1 (0.82) MCL1BCL2L11
SCHEMBL22975772 0.92 MCL1 (0.82) MCL1BCL2L11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210047344-A1 ALPHA-HYDROXY PHENYLACETIC ACID PHARMACOPHORE OR BIOISOSTERE MCL-1 PROTEIN ANTAGONISTS AMGEN INC. (US) 2021-02-18 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 (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-20210047344-A1 ALPHA-HYDROXY PHENYLACETIC ACID PHARMACOPHORE OR BIOISOSTERE MCL-1 PROTEIN ANTAGONISTS MCL1, BCL2A1, BCLAF1 MCL1 1/4885BCL2L11 7/4885

“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.