SCHEMBL22402967

SCHEMBL22402967

N#Cc1c2c(nn1I)CCC2

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
NSD2 O96028 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP2C9 P11712 1/20 0.33
KDM5A P29375 1/20 0.33
KDM5B Q9UGL1 1/20 0.33
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 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
SCHEMBL22402968 0.73 PARP1 (0.37) KDM4EALDH1A1NSD2MAPK1CYP2C9
SCHEMBL21836692 0.70 POLB (0.37) KDM4EALDH1A1NSD2MAPK1CYP2C9
SCHEMBL11643960 0.67 PTGS2 (0.43) POLBGAA
SCHEMBL11643633 0.64 PTGS2 (0.46) ALDH1A1MAPK1
SCHEMBL11743978 0.57 POLB (0.32) KDM4EALDH1A1MAPK1CYP1A2POLB
SCHEMBL14738537 0.57 POLB (0.52) KDM4EALDH1A1MAPK1CYP1A2POLB
SCHEMBL13160725 0.54 POLB (0.53) KDM4EALDH1A1CYP1A2POLBGAA
SCHEMBL14557158 0.54 POLB (0.43) KDM4EMAPK1CYP1A2POLBGAA
SCHEMBL9748738 0.54 MAPK1 (0.45) KDM4EALDH1A1NSD2MAPK1POLB
SCHEMBL23937891 0.54 KDM4E (0.33) KDM4EALDH1A1KDM5A

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-11786575-B2 Endoparasitic depsipeptides ZOETIS SERVICES LLC (US) 2023-10-17 US disclosed
US-20220211802-A1 Endoparasitic Depsipeptides ZOETIS SERVICES LLC 2022-07-07 US disclosed
US-11331369-B2 Endoparasitic depsipeptides ZOETIS SERVICES LLC (US) 2022-05-17 US disclosed
US-20200282016-A1 Endoparasitic Depsipeptides ZOETIS SERVICES LLC 2020-09-10 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 (4 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-11786575-B2 Endoparasitic depsipeptides VIP, PREP, NGLY1 KDM4E 3941/4885ALDH1A1 3102/4885NSD2 4605/4885
US-20200282016-A1 Endoparasitic Depsipeptides VIP, PREP, NGLY1 KDM4E 3941/4885ALDH1A1 3102/4885NSD2 4605/4885
US-20220211802-A1 Endoparasitic Depsipeptides VIP, PREP, NGLY1 KDM4E 3941/4885ALDH1A1 3102/4885NSD2 4605/4885
US-11331369-B2 Endoparasitic depsipeptides VIP, PREP, NGLY1 KDM4E 3941/4885ALDH1A1 3102/4885NSD2 4605/4885

“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.