SCHEMBL2732996

SCHEMBL2732996

CC(C)(C)OC(=O)N1CC(Oc2ccc(F)c(F)c2)C2C1CCN2C(=O)C(N)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 2/20 0.39
DPP9 Q86TI2 2/20 0.39
GPR119 Q8TDV5 2/20 0.38
DPP4 P27487 3/20 0.37
USP30 Q70CQ3 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
HRH2 P25021 2/20 0.35
HRH1 P35367 2/20 0.35
KIF11 P52732 1/20 0.35
KCNH2 Q12809 1/20 0.35
S1PR3 Q99500 1/20 0.34
MMP13 P45452 2/20 0.33
FAP Q12884 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HDAC8 Q9BY41 1/20 0.32
MMP2 P08253 1/20 0.32
MMP14 P50281 1/20 0.32

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
SCHEMBL9611330 1.00 DPP8 (0.39) DPP8DPP9GPR119DPP4USP30
SCHEMBL13017521 0.90 DPP9 (0.39) DPP8DPP9GPR119DPP4HRH2
SCHEMBL9611325 0.82 DPP9 (0.36) DPP8DPP9DPP4HRH2HRH1
SCHEMBL9611321 0.82 DPP9 (0.36) DPP8DPP9DPP4HRH2HRH1
SCHEMBL2706924 0.82 DPP9 (0.36) DPP8DPP9DPP4HRH2HRH1
SCHEMBL2725254 0.82 DPP9 (0.36) DPP8DPP9DPP4HRH2HRH1
SCHEMBL9611315 0.80 ELANE (0.42)
SCHEMBL8512140 0.80 ELANE (0.42)
SCHEMBL9611317 0.80 P2RX7 (0.41) KIF11KCNH2S1PR3
SCHEMBL8512180 0.80 P2RX7 (0.41) KIF11KCNH2S1PR3

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
US-8415486-B2 IAP inhibitors TETRALOGIC PHARMACEUTICALS CORP. (US) 2013-04-09 US disclosed
US-20120135990-A1 IAP INHIBITORS TETRALOGIC PHARMACEUTICALS CORP. (US) 2012-05-31 US disclosed
EP-2434890-A1 IAP INHIBITORS Tetralogic Pharmaceuticals Corp. (US) 2012-04-04 EP disclosed
WO-2010138666-A1 IAP INHIBITORS TETRALOGIC PHARMACEUTICALS CORP. (US) 2010-12-02 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-20120135990-A1 IAP INHIBITORS XIAP, IAPP, BIRC5 DPP8 32/4885DPP9 23/4885GPR119 163/4885

“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.