SCHEMBL25980466

SCHEMBL25980466

CON(C)C(=O)c1ccc(CN(C(=O)N2CCOCC2)c2cccc(Br)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.46
HDAC6 Q9UBN7 2/20 0.46
HDAC8 Q9BY41 1/20 0.46
KMT2A Q03164 8/20 0.40
MEN1 O00255 3/20 0.40
HDAC5 Q9UQL6 1/20 0.38
MTOR P42345 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
GAA P10253 1/20 0.38
PDK2 Q15119 1/20 0.38
PDK4 Q16654 1/20 0.38
GLA P06280 1/20 0.37

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
SCHEMBL25979032 0.90 LTB4R2 (0.40) HDAC1HDAC6HDAC8NPC1RAB9A
SCHEMBL25980457 0.88 KMT2A (0.46) HDAC1HDAC6HDAC8KMT2AMEN1
SCHEMBL16211817 0.87 ALDH1A1 (0.50) HDAC1HDAC6HDAC8KMT2AMEN1
SCHEMBL25979014 0.86 HDAC1 (0.50) HDAC1HDAC6HDAC8KMT2AHDAC5
SCHEMBL22686036 0.85 HDAC1 (0.51) HDAC1HDAC6HDAC8KMT2AHDAC5
SCHEMBL16211578 0.83 HDAC1 (0.49) HDAC1HDAC6HDAC8KMT2AHDAC5
SCHEMBL25980505 0.83 HDAC1 (0.42) HDAC1HDAC6HDAC8KMT2AMEN1
SCHEMBL25981458 0.79 HDAC1 (0.44) HDAC1HDAC6HDAC8KMT2AMEN1
SCHEMBL25980478 0.78 TSHR (0.47) KMT2AMEN1
SCHEMBL22217997 0.77 RAB9A (0.39) HDAC1HDAC6HDAC8KMT2AMEN1

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-20230248735-A1 COMPOSITIONS FOR PREVENTING OR TREATING CHRONIC OBSTRUCTIVE PULMONARY DISEASES (COPD) CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2023-08-10 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-20230248735-A1 COMPOSITIONS FOR PREVENTING OR TREATING CHRONIC OBSTRUCTIVE PULMONARY DISEASES (COPD) NR1H2, CFTR, CYP11B2 HDAC1 1635/4885HDAC6 997/4885HDAC8 2983/4885

“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.