SCHEMBL25979902

SCHEMBL25979902

O=C(NO)c1ccc(CN(C(=O)N2CC[C@H](F)C2)c2ccc(CF)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 18/20 0.41
HDAC8 Q9BY41 12/20 0.41
HDAC1 Q13547 11/20 0.41
HDAC3 O15379 6/20 0.41
HDAC2 Q92769 3/20 0.41
NCOR2 Q9Y618 3/20 0.41
HDAC11 Q96DB2 1/20 0.40
HDAC4 P56524 1/20 0.38
HDAC10 Q969S8 1/20 0.38

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
SCHEMBL16211265 0.90 HDAC6 (0.48) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL16211665 0.90 HDAC6 (0.48) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL16211267 0.90 HDAC6 (0.48) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL16211344 0.81 HDAC6 (0.52) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL16211681 0.81 HDAC6 (0.52) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL16211342 0.81 HDAC6 (0.52) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL25979867 0.80 HDAC6 (0.47) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL25981501 0.80 HDAC6 (0.49) HDAC6HDAC8HDAC1HDAC3HDAC11
SCHEMBL25981478 0.80 HDAC6 (0.47) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL16221514 0.79 DPP4 (0.44)

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 HDAC6 997/4885HDAC8 2983/4885HDAC1 1635/4885

“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.