SCHEMBL4775626

SCHEMBL4775626

NC(CCC(=O)O)C(=O)N1Cc2ccccc2C1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 11/20 0.67
DPP7 Q9UHL4 11/20 0.67
DPP9 Q86TI2 7/20 0.67
HDAC8 Q9BY41 8/20 0.66
DPP4 P27487 2/20 0.59
HDAC3 O15379 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51

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
SCHEMBL4775624 1.00 DPP8 (0.67) DPP8DPP7DPP9HDAC8DPP4
SCHEMBL4771240 0.86 HDAC8 (0.57) DPP8DPP7DPP9HDAC8DPP4
SCHEMBL4900688 0.86 HDAC8 (0.57) DPP8DPP7DPP9HDAC8DPP4
SCHEMBL4776344 0.81 DPP8 (0.65) DPP8DPP7DPP9HDAC8DPP4
SCHEMBL4911662 0.81 DPP8 (0.65) DPP8DPP7DPP9HDAC8DPP4
SCHEMBL20570474 0.80 HDAC8 (0.69) DPP8DPP7DPP9HDAC8DPP4
SCHEMBL28997417 0.80 DPP7 (1.00) DPP8DPP7DPP9HDAC8DPP4
SCHEMBL31653974 0.80 DPP7 (1.00) DPP8DPP7DPP9HDAC8DPP4
SCHEMBL21746926 0.80 DPP7 (1.00) DPP8DPP7DPP9HDAC8DPP4
SCHEMBL14523899 0.80 DPP4 (0.71) DPP8DPP7DPP9HDAC8DPP4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101282932-A Carboxyamine compounds and their use in the treatment of HDAC dependent diseases NOVARTIS AG (CH) 2008-10-08 CN claimed
EP-1996550-A2 CARBOXYAMINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF HDAC DEPENDENT DISEASES Novartis AG (CH) 2008-12-03 EP disclosed
US-20080255149-A1 Carboxyamine Compounds and Methods of Use Thereof NOVARTIS AG 2008-10-16 US disclosed
WO-2007038459-A2 CARBOXYAMINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF HDAC DEPENDENT DISEASES NOVARTIS AG (CH) 2007-04-05 WO 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-20080255149-A1 Carboxyamine Compounds and Methods of Use Thereof HNMT, HDAC5, HDAC4 DPP8 1164/4885DPP7 921/4885DPP9 848/4885

“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.