SCHEMBL23069262

SCHEMBL23069262

CCCc1cn(CC(=O)OCC)nn1

nearest known ligand 0.82

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.47
MAPK1 P28482 1/20 0.45
SRC P12931 1/20 0.45
PKM P14618 1/20 0.42
ATM Q13315 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
EP300 Q09472 6/20 0.41
MAPK14 Q16539 1/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GLA P06280 1/20 0.40

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
SCHEMBL16033032 0.91 GGPS1 (0.48) CYP19A1MAPK1SRCEP300L3MBTL1
SCHEMBL14788175 0.88 MAPK1 (0.51) MAPK1SRCPKMATMHSD17B10
SCHEMBL14104171 0.87 SRC (0.43) MAPK1SRCPKMATMHSD17B10
SCHEMBL16612622 0.86 MAPK1 (0.46) MAPK1SRCPKMATMHSD17B10
SCHEMBL16612208 0.85 MAPK1 (0.45) MAPK1SRCPKMATMHSD17B10
SCHEMBL15121329 0.85 SRC (0.47) MAPK1SRCPKMATMHSD17B10
SCHEMBL23069274 0.85 CYP19A1 (0.42) CYP19A1SRCNPSR1L3MBTL1
SCHEMBL23069258 0.85 CYP19A1 (0.42) CYP19A1SRC
SCHEMBL12847886 0.84 SRC (0.44) MAPK1SRCPKMATMHSD17B10
SCHEMBL18079400 0.83 EP300 (0.55) CYP19A1EP300

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220324770-A1 NITRIFICATION INHIBITORS THE UNIVERSITY OF MELBOURNE (AU) 2022-10-13 US claimed
EP-4025564-A1 NITRIFICATION INHIBITORS The University of Melbourne (AU) 2022-07-13 EP claimed
CN-114616227-A Nitrification inhibitors 墨尔本大学 2022-06-10 CN claimed
WO-2021042169-A1 NITRIFICATION INHIBITORS THE UNIVERSITY OF MELBOURNE (AU) 2021-03-11 WO claimed
CN-114616227-B Nitrification inhibitor 墨尔本大学 2025-01-21 CN disclosed
US-20220324770-A1 NITRIFICATION INHIBITORS THE UNIVERSITY OF MELBOURNE (AU) 2022-10-13 US disclosed
EP-4025564-A1 NITRIFICATION INHIBITORS The University of Melbourne (AU) 2022-07-13 EP disclosed
CN-114616227-A Nitrification inhibitors 墨尔本大学 2022-06-10 CN disclosed
WO-2021042169-A1 NITRIFICATION INHIBITORS THE UNIVERSITY OF MELBOURNE (AU) 2021-03-11 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-20220324770-A1 NITRIFICATION INHIBITORS NOS1, NOS2, NIT2 CYP19A1 175/4885MAPK1 1309/4885SRC 3709/4885

“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.