SCHEMBL4770429

SCHEMBL4770429

O=C(O)c1cn(CC(F)(F)F)nn1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.43
NOTUM Q6P988 1/20 0.40
CA5A P35218 1/20 0.38
TGM2 P21980 4/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
GRM2 Q14416 1/20 0.36
GGPS1 O95749 1/20 0.35
SCD O00767 1/20 0.35
GLS O94925 3/20 0.34
NR1H4 Q96RI1 1/20 0.33
HDAC9 Q9UKV0 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
SCHEMBL25333230 0.83 DPP4 (0.47) DPP4NOTUMCA5ATGM2ALDH1A1
SCHEMBL20615682 0.82 DPP4 (0.40) DPP4NOTUMCA5ATGM2ALDH1A1
SCHEMBL30322972 0.80 DPP4 (0.45) DPP4NOTUMGLSHDAC9
SCHEMBL30322942 0.78 ALDH1A1 (0.59) ALDH1A1LMNA
SCHEMBL27144814 0.77 SRC (0.50) GGPS1NR1H4
SCHEMBL15589751 0.76 DPP4 (0.50) DPP4NOTUMCA5ATGM2ALDH1A1
SCHEMBL4134269 0.76 DPP4 (0.43) DPP4CA5ATGM2ALDH1A1LMNA
SCHEMBL6072289 0.76 ALDH1A1 (0.45) DPP4CA5ATGM2ALDH1A1LMNA
SCHEMBL31124067 0.75 DPP4 (0.49) DPP4NOTUMCA5ATGM2ALDH1A1
SCHEMBL17630704 0.74 DPP4 (0.48) DPP4CA5ATGM2ALDH1A1LMNA

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-20240376085-A1 BENZIMIDAZOLES AS MODULATORS OF IL-17 JANSSEN PHARMACEUTICA NV (BE) 2024-11-14 US disclosed
EP-4408530-A1 BENZIMIDAZOLES AS MODULATORS OF IL-17 Janssen Pharmaceutica NV (BE) 2024-08-07 EP disclosed
WO-2023049888-A1 BENZIMIDAZOLES AS MODULATORS OF IL-17 JANSSEN PHARMACEUTICA NV (BE) 2023-03-30 WO disclosed
EP-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 EP 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-20240376085-A1 BENZIMIDAZOLES AS MODULATORS OF IL-17 IL17A, IL23R, IL4I1 DPP4 2900/4885NOTUM 4415/4885CA5A 1839/4885

“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.