SCHEMBL4921918

SCHEMBL4921918

NC(=O)CCc1ccc(Oc2ccc(CC(N)C(=O)N3CCNCC3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.40
DPP4 P27487 8/20 0.40
FAP Q12884 1/20 0.40
DPP8 Q6V1X1 1/20 0.40
DPP9 Q86TI2 1/20 0.40
DPP7 Q9UHL4 1/20 0.40
HDAC8 Q9BY41 6/20 0.39
AKT1 P31749 1/20 0.39
AKT2 P31751 1/20 0.39
AKT3 Q9Y243 1/20 0.39
PLAU P00749 1/20 0.39
PLAUR Q03405 1/20 0.39
HRH2 P25021 2/20 0.39
HRH1 P35367 2/20 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
SCHEMBL4925531 0.92 FFAR1 (0.50) FFAR1DPP4FAPDPP8DPP9
SCHEMBL4920322 0.86 FKBP1A (0.49) FFAR1DPP4FAPDPP8DPP9
SCHEMBL4914576 0.86 HSD17B10 (0.43) FFAR1DPP4FAPDPP8DPP9
SCHEMBL5125563 0.86 PARP10 (0.45) DPP4FAPDPP8DPP9DPP7
SCHEMBL4918414 0.79 FFAR1 (0.51) FFAR1
SCHEMBL4917954 0.78 FFAR1 (0.50) FFAR1DPP4FAPDPP8DPP9
SCHEMBL4917134 0.78 FKBP1A (0.50) FFAR1DPP4HDAC8
SCHEMBL5746200 0.78 HDAC8 (0.62) DPP4HDAC8HRH2HRH1
SCHEMBL5746194 0.78 HDAC8 (0.62) DPP4HDAC8HRH2HRH1
SCHEMBL3140448 0.76 DPP4 (0.60) DPP4FAPDPP8DPP9DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080175795-A1 Novel derivatives of amino acids for treatment of obesity and related disorders BEXEL PHARMACEUTICALS, INC. 2008-07-24 US claimed
US-20080175795-A1 Novel derivatives of amino acids for treatment of obesity and related disorders BEXEL PHARMACEUTICALS, INC. 2008-07-24 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-20080175795-A1 Novel derivatives of amino acids for treatment of obesity and related disorders GPR119, AADAT, FABP4 FFAR1 14/4885DPP4 38/4885FAP 1501/4885

“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.