SCHEMBL25932180

SCHEMBL25932180

COC(=O)c1cccc2c1CN(c1ccc3nc(C)ccc3n1)C2(C)C

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC11 Q96DB2 10/20 0.52
HDAC8 Q9BY41 2/20 0.43
KDM4E B2RXH2 4/20 0.35
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
POLB P06746 1/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PKM P14618 1/20 0.33
TRPA1 O75762 1/20 0.33

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
SCHEMBL25932179 0.87 HDAC11 (0.67) HDAC11HDAC8
SCHEMBL25932170 0.87 HDAC11 (0.54) HDAC11HDAC8KDM4EMEN1KMT2A
SCHEMBL21496793 0.86 HDAC11 (0.58) HDAC11HDAC8
SCHEMBL21496689 0.81 HDAC11 (0.70) HDAC11HDAC8
SCHEMBL25932190 0.78 HDAC11 (0.59) HDAC11HDAC8KDM4ETRPA1
SCHEMBL21496854 0.75 HDAC11 (0.51) HDAC11HDAC8KDM4EKMT2AALDH1A1
SCHEMBL30039052 0.75 HDAC11 (0.65) HDAC11HDAC8
SCHEMBL21500465 0.75 HDAC11 (0.65) HDAC11HDAC8
SCHEMBL25932167 0.74 HDAC11 (0.69) HDAC11HDAC8
SCHEMBL21496843 0.74 HDAC11 (0.58) HDAC11HDAC8KDM4EKMT2AALDH1A1

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-20230242512-A1 ISOINDOLINES AS HDAC INHIBITORS VALO HEALTH, INC. 2023-08-03 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-20230242512-A1 ISOINDOLINES AS HDAC INHIBITORS HDAC1, HDAC2, HDAC3 HDAC11 4/4885HDAC8 9/4885KDM4E 204/4885

“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.