SCHEMBL29554208

SCHEMBL29554208

C=C[C@H]1CCCC(=O)[C@@H]1C

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
KMT2A Q03164 1/20 0.39
MAPT P10636 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
SCHEMBL23688590 1.00 CA1 (0.40) CA1CA2CA4KMT2AMAPT
SCHEMBL19302210 1.00 CA1 (0.40) CA1CA2CA4KMT2AMAPT
SCHEMBL23688592 1.00 CA1 (0.40) CA1CA2CA4KMT2AMAPT
SCHEMBL23688589 1.00 CA1 (0.40) CA1CA2CA4KMT2AMAPT
SCHEMBL19285608 1.00 CA1 (0.40) CA1CA2CA4KMT2AMAPT
SCHEMBL19565871 0.87
SCHEMBL19548872 0.87
SCHEMBL22957070 0.87
SCHEMBL2068500 0.75 MAPT (0.39) CA1CA2CA4KMT2AMAPT
SCHEMBL9501225 0.75 KMT2A (0.44) CA1CA2CA4KMT2A

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-11306107-B2 Compounds that inhibit MCL-1 protein AMGEN INC. (US) 2022-04-19 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-11306107-B2 Compounds that inhibit MCL-1 protein MCL1, BCL9, BCL2L1 CA1 4607/4885CA2 4701/4885CA4 4869/4885

“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.