SCHEMBL21158478

SCHEMBL21158478

CC(C)C(=O)CCCCCCN1C(=O)C(Br)=C(Br)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 5/20 0.41
▸ HDAC1 Q13547 5/20 0.41
▸ HDAC3 O15379 4/20 0.41
▸ HDAC4 P56524 4/20 0.41
▸ HDAC7 Q8WUI4 4/20 0.41
▸ HDAC2 Q92769 4/20 0.41
▸ HDAC10 Q969S8 4/20 0.41
▸ HDAC11 Q96DB2 4/20 0.41
▸ HDAC6 Q9UBN7 4/20 0.41
▸ HDAC9 Q9UKV0 4/20 0.41
▸ HDAC5 Q9UQL6 4/20 0.41
▸ PTGS1 P23219 4/20 0.38
▸ PTGS2 P35354 4/20 0.38
▸ ALDH1A1 P00352 5/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ LTA4H P09960 1/20 0.37
▸ NCOR2 Q9Y618 1/20 0.37
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ HPGD P15428 1/20 0.35

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
SCHEMBL16283425 1.00 HDAC8 (0.41) HDAC8HDAC1HDAC3HDAC4HDAC7
SCHEMBL21158479 1.00 HDAC8 (0.41) HDAC8HDAC1HDAC3HDAC4HDAC7
SCHEMBL21158483 1.00 HDAC8 (0.41) HDAC8HDAC1HDAC3HDAC4HDAC7
SCHEMBL23286112 0.81 PAOX (0.44) HDAC8HDAC1HDAC3HDAC4HDAC7
SCHEMBL16283423 0.80 PTGS1 (0.40) HDAC8HDAC1HDAC3HDAC4HDAC7
SCHEMBL21111525 0.79 PTGS1 (0.59) HDAC8HDAC1HDAC3HDAC4HDAC7
SCHEMBL19281038 0.79 PTGS1 (0.59) HDAC8HDAC1HDAC3HDAC4HDAC7
SCHEMBL19280998 0.79 PTGS1 (0.59) HDAC8HDAC1HDAC3HDAC4HDAC7
SCHEMBL15011303 0.79 PTGS1 (0.59) HDAC8HDAC1HDAC3HDAC4HDAC7
SCHEMBL20210375 0.79 HDAC8 (0.45) HDAC8HDAC1HDAC3HDAC4HDAC7

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-20190209704-A1 NOVEL ANTIBODY-DRUG CONJUGATES AND RELATED COMPOUNDS, COMPOSITIONS AND METHODS OF USE SENSEI BIOTHERAPEUTICS, INC. 2019-07-11 — — 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-20190209704-A1 NOVEL ANTIBODY-DRUG CONJUGATES AND RELATED COMPOUNDS, COMPOSITIONS AND METHODS OF USE CYTH3, CD47, FCGRT HDAC8 1259/4885HDAC1 3071/4885HDAC3 1725/4885

“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.

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