SCHEMBL25979873

SCHEMBL25979873

CC(=O)c1ccc(CN(C(=O)N2CC[C@@H](F)C2)c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.43
DPP7 Q9UHL4 2/20 0.43
MAOB P27338 1/20 0.42
MCHR1 Q99705 9/20 0.42
PDK2 Q15119 1/20 0.42
PDK4 Q16654 1/20 0.42
DPP8 Q6V1X1 1/20 0.41
LSS P48449 1/20 0.41
PDK1 Q15118 1/20 0.41
HDAC6 Q9UBN7 2/20 0.40
KCNH2 Q12809 1/20 0.40
SLC6A5 Q9Y345 1/20 0.39
TEAD1 P28347 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC8 Q9BY41 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
SCHEMBL16221514 0.91 DPP4 (0.44) DPP4DPP7MCHR1PDK2PDK4
SCHEMBL16211371 0.89 SLC6A5 (0.41) DPP4DPP7MCHR1PDK2PDK4
SCHEMBL16211388 0.89 SLC6A5 (0.41) DPP4DPP7MCHR1PDK2PDK4
SCHEMBL16211373 0.89 SLC6A5 (0.41) DPP4DPP7MCHR1PDK2PDK4
SCHEMBL16211265 0.89 HDAC6 (0.48) DPP4DPP7LSSHDAC6SLC6A5
SCHEMBL16211665 0.89 HDAC6 (0.48) DPP4DPP7LSSHDAC6SLC6A5
SCHEMBL16211267 0.89 HDAC6 (0.48) DPP4DPP7LSSHDAC6SLC6A5
SCHEMBL25981501 0.81 HDAC6 (0.49) MCHR1LSSHDAC6SLC6A5HDAC1
SCHEMBL25979867 0.79 HDAC6 (0.47) LSSHDAC6SLC6A5TEAD1HDAC1
SCHEMBL25979924 0.79 SPHK2 (0.43) DPP4DPP7MAOBPDK2PDK4

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 DPP4 3323/4885DPP7 3071/4885MAOB 569/4885

“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.