SCHEMBL29798802

SCHEMBL29798802

CC(C)(C)OC(=O)N1Cc2cc(Cl)ccc2CC1C=O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 11/20 0.46
PTPN1 P18031 5/20 0.45
ALDH1A1 P00352 1/20 0.43
NR1H2 P55055 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ESR2 Q92731 1/20 0.41

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
SCHEMBL2730295 1.00 HDAC8 (0.46) HDAC8PTPN1ALDH1A1NR1H2MEN1
SCHEMBL19460349 0.86 HDAC8 (0.48) HDAC8PTPN1NR1H2MEN1KMT2A
SCHEMBL19460348 0.86 HDAC8 (0.48) HDAC8PTPN1NR1H2MEN1KMT2A
SCHEMBL29798888 0.84 MEN1 (0.46) HDAC8PTPN1ALDH1A1NR1H2MEN1
SCHEMBL19329217 0.84 HDAC8 (0.53) HDAC8PTPN1
SCHEMBL19329216 0.84 HDAC8 (0.53) HDAC8PTPN1
SCHEMBL2732550 0.84 MEN1 (0.46) HDAC8PTPN1ALDH1A1NR1H2MEN1
SCHEMBL19329082 0.83 PTPN1 (0.45) HDAC8PTPN1NR1H2MEN1KMT2A
SCHEMBL19329080 0.83 PTPN1 (0.45) HDAC8PTPN1NR1H2MEN1KMT2A
SCHEMBL19329064 0.83 PTPN1 (0.43) HDAC8PTPN1NR1H2MEN1KMT2A

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-11389464-B2 Arginase inhibitors as therapeutics MARS, INCORPORATED (US) 2022-07-19 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-11389464-B2 Arginase inhibitors as therapeutics ARG1, ARG2, PRMT1 HDAC8 1057/4885PTPN1 2334/4885ALDH1A1 1448/4885

“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.