SCHEMBL8092352

SCHEMBL8092352

COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C1CC2CCC(C1)N2C(=O)c1ccnc(F)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.37
PREP P48147 1/20 0.36
FAP Q12884 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 1/20 0.36
ACACB O00763 2/20 0.34
ACACA Q13085 1/20 0.34
AAK1 Q2M2I8 3/20 0.34
JAK2 O60674 2/20 0.34
JAK1 P23458 2/20 0.34
CACNA1B Q00975 3/20 0.32
REN P00797 2/20 0.32
IDO1 P14902 1/20 0.31
KDM1A O60341 1/20 0.31
EIF2AK4 Q9P2K8 1/20 0.31
GPR119 Q8TDV5 1/20 0.31

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
SCHEMBL3748577 0.85 MGLL (0.38) MGLLPREPFAPTAS1R3TAS1R1
SCHEMBL3736510 0.84 MGLL (0.39) MGLLPREPFAPTAS1R3TAS1R1
SCHEMBL3738226 0.84 MGLL (0.39) MGLLPREPFAPTAS1R3TAS1R1
SCHEMBL13078576 0.81 DPP4 (0.37) AAK1CACNA1BREN
SCHEMBL8080997 0.77 PREP (0.35) MGLLPREPFAPTAS1R3TAS1R1
SCHEMBL3755810 0.76 PREP (0.34) MGLLPREPFAPTAS1R3TAS1R1
SCHEMBL3744735 0.76 DPP4 (0.42)
SCHEMBL3744329 0.76 DPP4 (0.38) MGLLPREPFAPTAS1R3TAS1R1
SCHEMBL13078895 0.76 DPP4 (0.38) MGLLPREPFAPTAS1R3TAS1R1
SCHEMBL8097461 0.75 DPP4 (0.41) AAK1CACNA1BGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338450-B2 Compounds as dipeptidyl peptidase IV (DPP IV) inhibitors LUPIN LIMITED (IN) 2012-12-25 US disclosed
US-20100291020-A1 NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS LUPIN LIMITED (IN) 2010-11-18 US disclosed
WO-2009037719-A1 NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS LUPIN LIMITED (IN) 2009-03-26 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-20100291020-A1 NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS DPP4, DPP7, DPP3 MGLL 1847/4885PREP 32/4885FAP 26/4885

“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.