SCHEMBL23928116

SCHEMBL23928116

COCCOCCOCCOCCOCCNc1ccc(CCN)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.46
CYP3A4 P08684 1/20 0.46
ADRA2B P18089 1/20 0.46
OPRD1 P41143 1/20 0.46
SCN5A Q14524 1/20 0.46
TAAR1 Q96RJ0 8/20 0.43
MAPT P10636 2/20 0.42
MAOB P27338 2/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2A6 P11509 1/20 0.39
HTR2A P28223 1/20 0.39
GAA P10253 1/20 0.37
KDM4E B2RXH2 2/20 0.37
ATM Q13315 1/20 0.37
KCNH3 Q9ULD8 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
SLC6A2 P23975 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL23928184 1.00 ABCB11 (0.46) ABCB11CYP3A4ADRA2BOPRD1SCN5A
SCHEMBL11862668 0.90 TAAR1 (0.48) TAAR1MAPTMAOBCYP1A2CYP2A6
SCHEMBL23963381 0.84 TAAR1 (0.46) ABCB11CYP3A4ADRA2BOPRD1SCN5A
SCHEMBL23963323 0.84 TAAR1 (0.46) TAAR1MAPTMAOBCYP1A2CYP2A6
SCHEMBL18394327 0.83 ABCB11 (0.47) ABCB11CYP3A4ADRA2BOPRD1SCN5A
SCHEMBL30800855 0.80 ABCB11 (0.49) ABCB11CYP3A4ADRA2BOPRD1SCN5A
SCHEMBL23291240 0.79 ABCB11 (0.50) ABCB11CYP3A4ADRA2BOPRD1SCN5A
SCHEMBL23963379 0.78 TAAR1 (0.47) TAAR1MAPTMAOBCYP1A2CYP2A6
SCHEMBL14982724 0.76 KCNH3 (0.51) ABCB11CYP3A4ADRA2BOPRD1SCN5A
SCHEMBL9015900 0.76 KCNH3 (0.51) ABCB11CYP3A4ADRA2BOPRD1SCN5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3814356-B1 TRIAZOLOTRIAZINE DERIVATIVES AS A2A RECEPTOR ANTAGONISTS ZHEJIANG VIMGREEN PHARMACEUTICALS LTD (CN) 2026-03-11 EP disclosed
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 ABCB11 783/4885CYP3A4 900/4885ADRA2B 29/4885
US-20210332055-A1 TRIAZOLOTRIAZINE DERIVATIVES AS A2A RECEPTOR ANTAGONISTS ADORA2A, ADORA1, ADORA3 ABCB11 783/4885CYP3A4 900/4885ADRA2B 29/4885

“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.