SCHEMBL26935089

SCHEMBL26935089

CSCCC1NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C2CCCN2C(=O)C(CCC(=O)O)NC(=O)C(CCCNC(=N)N)NC(=O)C(CC(C)C)NC(=O)C2CCCN2C1=O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 3/20 0.57
HDAC3 O15379 2/20 0.57
HDAC4 P56524 2/20 0.57
HDAC1 Q13547 2/20 0.57
HDAC7 Q8WUI4 2/20 0.57
HDAC2 Q92769 2/20 0.57
HDAC10 Q969S8 2/20 0.57
HDAC11 Q96DB2 2/20 0.57
HDAC6 Q9UBN7 2/20 0.57
HDAC9 Q9UKV0 2/20 0.57
HDAC5 Q9UQL6 2/20 0.57
PCSK9 Q8NBP7 1/20 0.56
KLK5 Q9Y337 2/20 0.56
KLKB1 P03952 7/20 0.56
F12 P00748 3/20 0.54

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
SCHEMBL26935091 0.92 PCSK9 (0.63) HDAC8HDAC3HDAC4HDAC1HDAC7
SCHEMBL26935070 0.88 HDAC3 (0.58) HDAC8HDAC3HDAC4HDAC1HDAC7
SCHEMBL26935065 0.87 HDAC3 (0.60) HDAC8HDAC3HDAC4HDAC1HDAC7
SCHEMBL26935098 0.86 PCSK9 (0.55) HDAC8HDAC3HDAC4HDAC1HDAC7
SCHEMBL31046792 0.83 HDAC3 (0.59) HDAC8HDAC3HDAC4HDAC1HDAC7
SCHEMBL30866243 0.82 HDAC3 (0.58) HDAC8HDAC3HDAC4HDAC1HDAC7
SCHEMBL25941528 0.82 PCSK9 (0.62) PCSK9KLKB1
SCHEMBL31609179 0.81 HDAC3 (0.61) HDAC8HDAC3HDAC4HDAC1HDAC7
SCHEMBL30866247 0.80 HDAC3 (0.62) HDAC8HDAC3HDAC4HDAC1HDAC7
SCHEMBL31615094 0.80 HDAC3 (0.62) HDAC8HDAC3HDAC4HDAC1HDAC7

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-20230399362-A1 INTERLEUKIN-13 BINDING CYCLIC OLIGOPEPTIDES AND METHODS OF USE THEREOF B.A.I. LABORATORIES, LLC 2023-12-14 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-20230399362-A1 INTERLEUKIN-13 BINDING CYCLIC OLIGOPEPTIDES AND METHODS OF USE THEREOF CXCL10, IL23R, CCL11 HDAC8 2034/4885HDAC3 3181/4885HDAC4 2761/4885

“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.