SCHEMBL14970366

SCHEMBL14970366

CC(=O)N1Cc2nnc(C(F)(F)F)n2C(C)(C)C1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.53
DPP8 Q6V1X1 8/20 0.53
DPP9 Q86TI2 4/20 0.53
DPP7 Q9UHL4 3/20 0.53
LRRK2 Q5S007 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
P2RX7 Q99572 1/20 0.32
ACE P12821 1/20 0.31
HTR2A P28223 1/20 0.31
FAP Q12884 1/20 0.31
AR P10275 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
SCHEMBL16222219 0.69 PDK1 (0.46) DPP4DPP8DPP9DPP7P2RX7
SCHEMBL6567477 0.64 SMN1; SMN2 (0.52) SMN1; SMN2
SCHEMBL3135974 0.62 DPP4 (0.55) DPP4DPP8DPP9DPP7ACE
SCHEMBL6567483 0.60 SMN1; SMN2 (0.52) SMN1; SMN2
SCHEMBL21425239 0.60 DPP4 (0.53) DPP4DPP8DPP9DPP7ACE
SCHEMBL22703440 0.60 DPP4 (0.53) DPP4DPP8DPP9DPP7ACE
SCHEMBL26634466 0.58
SCHEMBL14297362 0.58
SCHEMBL11948486 0.58 DPP4 (0.60) DPP4DPP8DPP9DPP7ACE
SCHEMBL12869368 0.57

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-2780337-B1 SUBSTITUTED CYCLOPROPYL COMPOUNDS USEFUL AS GPR119 AGONISTS MERCK SHARP & DOHME (US) 2017-12-20 EP disclosed
US-9018224-B2 Substituted cyclopropyl compounds useful as GPR119 agonists MERCK SHARP & DOHME CORP. (US) 2015-04-28 US disclosed
US-20140329798-A1 SUBSTITUTED CYCLOPROPYL COMPOUNDS USEFUL AS GPR119 AGONISTS MERCK SHARP & DOHME LLC 2014-11-06 US disclosed
WO-2013074388-A1 SUBSTITUTED CYCLOPROPYL COMPOUNDS USEFUL AS GPR119 AGONISTS MERCK SHARP & DOHME CORP. (US) 2013-05-23 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-20140329798-A1 SUBSTITUTED CYCLOPROPYL COMPOUNDS USEFUL AS GPR119 AGONISTS GPR119, GPR27, GCGR DPP4 620/4885DPP8 849/4885DPP9 380/4885

“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.