SCHEMBL17844752

SCHEMBL17844752

CC(OC(N)=O)c1cccc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 1/20 0.47
TRPM8 Q7Z2W7 5/20 0.46
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
PARP1 P09874 1/20 0.44
AOC3 Q16853 1/20 0.44
OGG1 O15527 1/20 0.44
DHFR P00374 2/20 0.42
ACP3 P15309 1/20 0.41
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41

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
SCHEMBL29927069 1.00 ADRA1D (0.47) ADRA1DTRPM8HPGDALOX15PARP1
SCHEMBL24729465 1.00 ADRA1D (0.47) ADRA1DTRPM8HPGDALOX15PARP1
SCHEMBL27480876 0.85 HPGD (0.46) ADRA1DTRPM8HPGDALOX15AOC3
SCHEMBL29141742 0.83 ADRA1D (0.39) ADRA1DTRPM8HPGDALOX15AOC3
SCHEMBL3424145 0.81 PARP1 (0.46) TRPM8PARP1AOC3ACP3
SCHEMBL3715003 0.81 ADRB1 (0.50) PARP1ADRB2ADRB1ADRB3
SCHEMBL27997344 0.81 HPGD (0.43) ADRA1DHPGDALOX15AOC3ACP3
SCHEMBL515036 0.80 PARP1 (0.44) HPGDPARP1
SCHEMBL27405841 0.80 PARP1 (0.44) ADRA1DTRPM8HPGDALOX15PARP1
SCHEMBL27469165 0.80 PARP1 (0.44) ADRA1DTRPM8HPGDALOX15PARP1

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-20240199612-A1 IMIDAZOPYRIDINYL INHIBITORS OF PLASMA KALLIKREIN SHIRE HUMAN GENETIC THERAPIES (US) 2024-06-20 US disclosed
EP-4308227-A1 IMIDAZOPYRIDINYL INHIBITORS OF PLASMA KALLIKREIN Takeda Pharmaceutical Company Limited (JP) 2024-01-24 EP disclosed
WO-2022197755-A1 IMIDAZOPYRIDINYL INHIBITORS OF PLASMA KALLIKREIN SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2022-09-22 WO disclosed
WO-2022197755-A1 IMIDAZOPYRIDINYL INHIBITORS OF PLASMA KALLIKREIN SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2022-09-22 WO disclosed
WO-2016095088-A1 ERK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-06-23 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-20240199612-A1 IMIDAZOPYRIDINYL INHIBITORS OF PLASMA KALLIKREIN KLKB1, KLK1, KLK4 ADRA1D 2135/4885TRPM8 1879/4885HPGD 668/4885

“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.