SCHEMBL23780448

SCHEMBL23780448

Fc1cc(CNc2cnccn2)ccc1-c1noc(C(F)(F)F)n1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 20/20 0.72
HDAC6 Q9UBN7 20/20 0.72
HDAC8 Q9BY41 13/20 0.72
HDAC5 Q9UQL6 17/20 0.68

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
SCHEMBL30172354 1.00 HDAC1 (0.72) HDAC1HDAC6HDAC8HDAC5
SCHEMBL30172420 0.85 HDAC1 (0.51) HDAC1HDAC6HDAC8HDAC5
SCHEMBL23291908 0.85 HDAC1 (0.51) HDAC1HDAC6HDAC8HDAC5
SCHEMBL19745104 0.84 HDAC6 (1.00) HDAC1HDAC6HDAC8
SCHEMBL19746125 0.81 HDAC1 (1.00) HDAC1HDAC6HDAC8HDAC5
SCHEMBL23780443 0.79 HDAC6 (0.72) HDAC1HDAC6HDAC8HDAC5
SCHEMBL19745617 0.78 HDAC1 (1.00) HDAC1HDAC6HDAC8HDAC5
SCHEMBL29373676 0.78 HDAC6 (0.62) HDAC1HDAC6HDAC8HDAC5
SCHEMBL22529989 0.77 HDAC1 (0.61) HDAC1HDAC6HDAC8HDAC5
SCHEMBL29376602 0.77 HDAC1 (0.61) HDAC1HDAC6HDAC8HDAC5

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-3814343-B1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS INC (US) 2023-01-11 EP claimed
EP-3814343-B1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS INC (US) 2023-01-11 EP disclosed
US-20210276991-A1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS, INC. 2021-09-09 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-20210276991-A1 CARDIAC SARCOMERE INHIBITORS TNNI3, TNNT2, MYLK2 HDAC1 203/4885HDAC6 233/4885HDAC8 647/4885

“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.