SCHEMBL8244656

SCHEMBL8244656

CC(C)CC(=O)N1CCc2ccccc2C1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 2/20 0.68
DPP7 Q9UHL4 1/20 0.68
NOTUM Q6P988 2/20 0.61
ACE P12821 2/20 0.61
KDM4E B2RXH2 1/20 0.59
MEN1 O00255 5/20 0.59
KMT2A Q03164 5/20 0.59
NLRP3 Q96P20 1/20 0.58
TAAR1 Q96RJ0 4/20 0.57
HDAC3 O15379 1/20 0.57
HDAC1 Q13547 1/20 0.57
HDAC10 Q969S8 1/20 0.57
HDAC11 Q96DB2 1/20 0.57
HRH3 Q9Y5N1 1/20 0.57
POLB P06746 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
MAPT P10636 1/20 0.55
HPGD P15428 1/20 0.55

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
SCHEMBL9138110 0.89 DPP8 (0.66) DPP8DPP7NOTUMACEKDM4E
SCHEMBL13918276 0.89 NOTUM (0.55) DPP8DPP7NOTUMACEKDM4E
SCHEMBL5870235 0.85 DPP8 (0.57) DPP8DPP7NOTUMACEKDM4E
SCHEMBL5870531 0.85 DPP8 (0.57) DPP8DPP7NOTUMACEKDM4E
SCHEMBL3103829 0.84 DPP8 (0.68) DPP8DPP7NOTUMACEKDM4E
SCHEMBL13487186 0.82 NOTUM (0.67) DPP8DPP7NOTUMACEKDM4E
SCHEMBL303340 0.82 NOTUM (0.67) DPP8DPP7NOTUMACEKDM4E
SCHEMBL5870438 0.82 DPP8 (0.54) DPP8DPP7NOTUMACEKDM4E
SCHEMBL4612404 0.81 ALDH1A1 (0.60) DPP8DPP7NOTUMACEKDM4E
SCHEMBL6972682 0.81 NR1H2 (0.51) DPP8DPP7NOTUMACEKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7786122-B2 α-(N-sulfonamido)acetamide derivatives as β-amyloid inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-08-31 US disclosed
US-7511062-B2 Substituted 2-quinolyl-oxazoles useful as PDE4 inhibitors SCHERING CORPORATION (US) 2009-03-31 US disclosed
US-20080085894-A1 ALPHA-(N-SULFONAMIDO)ACETAMIDE DERIVATIVES AS BETA-AMYLOID INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2008-04-10 US disclosed
US-7300936-B2 α-(N-sulfonamido)acetamide derivatives as β-amyloid inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-11-27 US disclosed
US-20070082907-A1 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (IN) 2007-04-12 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 (2 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-20080085894-A1 ALPHA-(N-SULFONAMIDO)ACETAMIDE DERIVATIVES AS BETA-AMYLOID INHIBITORS APP, APBA1, BACE1 DPP8 703/4885DPP7 362/4885NOTUM 2412/4885
US-20070082907-A1 Peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD DPP8 870/4885DPP7 797/4885NOTUM 1270/4885

“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.