SCHEMBL9923449

SCHEMBL9923449

CC(C)(C)OC(=O)NC1(c2ccc(-c3nnn[nH]3)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.47
AKT2 P31751 1/20 0.37
LPAR1 Q92633 1/20 0.37
PDE2A O00408 8/20 0.36
CNR1 P21554 2/20 0.36
CNR2 P34972 2/20 0.36
DRD2 P14416 5/20 0.33
PSMB8 P28062 1/20 0.32
KIT P10721 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
SCHEMBL9900850 0.81 PDE2A (0.37) AKT1PDE2A
SCHEMBL958441 0.78 CYP17A1 (0.51) PSMB8
SCHEMBL25156379 0.77 AKT1 (0.51) AKT1AKT2LPAR1PDE2ACNR1
SCHEMBL18551335 0.76 MIF (0.46) AKT1AKT2PDE2ACNR1CNR2
SCHEMBL24088159 0.75 L3MBTL1 (0.50) AKT1
SCHEMBL5640967 0.74 AKT1 (0.43) AKT1AKT2LPAR1PDE2ACNR1
SCHEMBL23778486 0.74 AKT1 (0.45) AKT1AKT2PDE2ACNR1CNR2
SCHEMBL2588632 0.74 NPC1 (0.47) AKT1AKT2PDE2ADRD2
SCHEMBL12196127 0.74 DRD2 (0.53) AKT1PDE2ACNR1CNR2DRD2
SCHEMBL14236180 0.74 AKT1 (0.43) AKT1AKT2LPAR1PDE2ACNR1

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
EP-2649061-B1 PYRIDINE AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS Rottapharm Biotech Srl (IT) 2015-05-13 EP disclosed
US-8828987-B2 Pyridine amide derivatives as EP4 receptor antagonists ROTTAPHARM BIOTECH S.R.L. (IT) 2014-09-09 US disclosed
US-20130261100-A1 PYRIDINE AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ROTTAPHARM BIOTECH S.R.L. (IT) 2013-10-03 US disclosed
WO-2012076063-A1 PYRIDINE AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS ROTTAPHARM S.P.A. (IT) 2012-06-14 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-20130261100-A1 PYRIDINE AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS PTGER4, PTGER1, CNR1 AKT1 2734/4885AKT2 3409/4885LPAR1 248/4885

“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.