SCHEMBL23928246

SCHEMBL23928246

O=C(O)NCCc1ccc(OCCN2CCCC(F)C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
HRH3 Q9Y5N1 4/20 0.49
LTA4H P09960 8/20 0.48
EPHX2 P34913 2/20 0.48
MC4R P32245 1/20 0.48
HTT P42858 1/20 0.46

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
SCHEMBL23928196 0.89 MC4R (0.50) KDM4EHRH3LTA4HMC4R
SCHEMBL23928167 0.86 KDM4E (0.45) KDM4EALDH1A1LMNAHRH3LTA4H
SCHEMBL23291284 0.86 KDM4E (0.45) KDM4EALDH1A1LMNAHRH3LTA4H
SCHEMBL23928153 0.85 LTA4H (0.64) KDM4EHRH3LTA4HEPHX2HTT
SCHEMBL23928172 0.84 LTA4H (0.63) KDM4EALDH1A1HRH3LTA4HEPHX2
SCHEMBL23928236 0.84 LTA4H (0.63) KDM4EALDH1A1HRH3LTA4HEPHX2
SCHEMBL23928208 0.81 HRH3 (0.56) KDM4EALDH1A1LMNAHRH3LTA4H
SCHEMBL23291315 0.81 HRH3 (0.56) KDM4EALDH1A1LMNAHRH3LTA4H
SCHEMBL23291212 0.79 HRH3 (0.66) KDM4EALDH1A1HRH3LTA4H
SCHEMBL23928135 0.78 HRH3 (0.68) KDM4EALDH1A1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11845751-B2 Triazolotriazine derivatives as A2A receptor antagonists ZHEJIANG VIMGREEN PHARMACEUTICALS, LTD. (CN) 2023-12-19 US disclosed
US-20210332055-A1 TRIAZOLOTRIAZINE DERIVATIVES AS A2A RECEPTOR ANTAGONISTS ZHEJIANG VIMGREEN PHARMACEUTICALS, LTD. (CN) 2021-10-28 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 (2 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-11845751-B2 Triazolotriazine derivatives as A2A receptor antagonists ADORA2A, ADORA1, ADORA3 KDM4E 3952/4885ALDH1A1 571/4885LMNA 3595/4885
US-20210332055-A1 TRIAZOLOTRIAZINE DERIVATIVES AS A2A RECEPTOR ANTAGONISTS ADORA2A, ADORA1, ADORA3 KDM4E 3952/4885ALDH1A1 571/4885LMNA 3595/4885

“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.