SCHEMBL1925033

SCHEMBL1925033

COC(=O)N1CC(c2c[nH]c3cc(F)ccc23)C2C1=CCN2C(=O)C(N)C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP9 Q86TI2 4/20 0.41
DPP4 P27487 6/20 0.40
DPP8 Q6V1X1 3/20 0.40
HTR2A P28223 2/20 0.34
HSD11B1 P28845 2/20 0.34
SLC6A4 P31645 3/20 0.34
ADRA1D P25100 2/20 0.34
KCNH2 Q12809 5/20 0.33
DPP7 Q9UHL4 4/20 0.33
DRD2 P14416 2/20 0.33
HTR7 P34969 1/20 0.33

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
SCHEMBL2442469 0.87 AAK1 (0.34) HTR2AHSD11B1SLC6A4ADRA1DKCNH2
SCHEMBL2442353 0.86 XIAP (0.41)
SCHEMBL2445839 0.82 XIAP (0.32) HTR2ASLC6A4KCNH2DRD2HTR7
SCHEMBL12299610 0.80 DPP9 (0.41) DPP9DPP4DPP8HTR2AHSD11B1
SCHEMBL1925030 0.80 DPP9 (0.41) DPP9DPP4DPP8HTR2AHSD11B1
SCHEMBL2446124 0.78 CTSL (0.42)
SCHEMBL12299761 0.75 DPP9 (0.45) DPP9DPP4DPP8HTR2AHSD11B1
SCHEMBL2447641 0.75 DPP9 (0.45) DPP9DPP4DPP8HTR2AHSD11B1
SCHEMBL2440601 0.73 TGM2 (0.33) DPP8HTR2ASLC6A4KCNH2DRD2
SCHEMBL2442069 0.73 SCN9A (0.33) HTR2ASLC6A4ADRA1DKCNH2DRD2

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-8399683-B2 IAP inhibitors TETRALOGIC PHARMACEUTICALS (US) 2013-03-19 US disclosed
US-20110237517-A1 IAP INHIBITORS TETRALOGIC PHARMACEUTICALS CORP. 2011-09-29 US disclosed
EP-2328412-A1 IAP INHIBITORS Tetralogic Pharmaceuticals Corp. (US) 2011-06-08 EP disclosed
WO-2010033531-A1 IAP INHIBITORS TETRALOGIC PHARMACEUTICALS CORP. (US) 2010-03-25 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-20110237517-A1 IAP INHIBITORS XIAP, IAPP, BIRC5 DPP9 23/4885DPP4 34/4885DPP8 32/4885

“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.