SCHEMBL25979607

SCHEMBL25979607

Cc1cc(N(Cc2ccc(C(=O)NO)cc2)C(=O)N2CCOCC2)ccc1F

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 7/20 0.43
HDAC1 Q13547 4/20 0.43
HDAC8 Q9BY41 4/20 0.43
MLYCD O95822 7/20 0.41
HDAC3 O15379 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.41
PDK2 Q15119 1/20 0.40
PDK4 Q16654 1/20 0.40
HDAC2 Q92769 1/20 0.40
GAA P10253 1/20 0.39

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
SCHEMBL25979588 0.90 HDAC6 (0.50) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL16211813 0.88 HDAC6 (0.43) HDAC6HDAC1HDAC8MLYCDHDAC3
SCHEMBL25979600 0.87 HDAC6 (0.41) HDAC6HDAC1HDAC8HDAC3ALDH1A1
SCHEMBL25980709 0.86 MLYCD (0.48) HDAC6HDAC1HDAC8MLYCDHDAC3
SCHEMBL29878916 0.85 MAPK1 (0.43) HDAC6HDAC1HDAC8MLYCDHDAC3
SCHEMBL17623522 0.84 HDAC1 (0.49) HDAC6HDAC1HDAC8MLYCDALDH1A1
SCHEMBL16211386 0.84 HDAC6 (0.51) HDAC6HDAC1HDAC8ALDH1A1TP53
SCHEMBL23436417 0.83 NPC1 (0.48) HDAC6HDAC1HDAC8MLYCDALDH1A1
SCHEMBL16211346 0.83 STAT3 (0.46) HDAC6HDAC1HDAC8MLYCDHDAC3
SCHEMBL18910372 0.83 MLYCD (0.46) HDAC6HDAC1HDAC8MLYCDHDAC3

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 997/4885HDAC1 1635/4885HDAC8 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.