SCHEMBL23213450

SCHEMBL23213450

N#Cc1cnc(NN)nc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 1.00
GAA P10253 3/20 1.00
ALDH1A1 P00352 2/20 1.00
L3MBTL1 Q9Y468 2/20 1.00
LMNA P02545 1/20 1.00
HTT P42858 1/20 0.42
SYK P43405 2/20 0.36
MAPT P10636 2/20 0.34
CHEK1 O14757 1/20 0.33
CYP19A1 P11511 1/20 0.32
GRM5 P41594 1/20 0.32
EGLN2 Q96KS0 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
IDO1 P14902 1/20 0.31
VNN1 O95497 1/20 0.31
XDH P47989 1/20 0.31

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
SCHEMBL7455400 0.78 KDM4E (0.64) KDM4EGAAALDH1A1L3MBTL1LMNA
SCHEMBL1421234 0.74
SCHEMBL312324 0.74
SCHEMBL247841 0.73 KDM4E (0.57) KDM4EGAAALDH1A1L3MBTL1LMNA
SCHEMBL29624542 0.73 KDM4E (0.57) KDM4EGAAALDH1A1L3MBTL1LMNA
Water SCHEMBL6221139 0.73 KDM4E (0.57) KDM4EGAAALDH1A1L3MBTL1LMNA
SCHEMBL7454746 0.73 ALDH1A1 (0.57) KDM4EGAAALDH1A1L3MBTL1LMNA
SCHEMBL17036646 0.73 KDM4E (0.57) KDM4EGAAALDH1A1L3MBTL1LMNA
SCHEMBL20998357 0.73 LMNA (0.57) KDM4EGAAALDH1A1L3MBTL1LMNA
SCHEMBL13037671 0.73 KDM4E (0.56) KDM4EGAAALDH1A1L3MBTL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4041393-B1 NOVEL HETEROARYL-TRIAZOLE COMPOUNDS AS PESTICIDES BAYER AG (DE) 2026-04-08 EP disclosed
CN-114867529-B Novel heteroaryl triazole compounds as pesticides 拜耳公司 2024-09-27 CN disclosed
CN-117567338-A Novel heteroaryl triazole compounds as pesticides 拜耳公司 2024-02-20 CN disclosed
US-20230028441-A1 NOVEL HETEROARYL-TRIAZOLE COMPOUNDS AS PESTICIDES ELANCO ANIMAL HEALTH GMBH (DE) 2023-01-26 US disclosed
EP-4041393-A1 NOVEL HETEROARYL-TRIAZOLE COMPOUNDS AS PESTICIDES Bayer Aktiengesellschaft (DE) 2022-08-17 EP disclosed
CN-114867529-A Novel heteroaryl triazole compounds as pesticides 拜耳公司 2022-08-05 CN disclosed
WO-2021069567-A1 NOVEL HETEROARYL-TRIAZOLE COMPOUNDS AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2021-04-15 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-20230028441-A1 NOVEL HETEROARYL-TRIAZOLE COMPOUNDS AS PESTICIDES PRXL2A, GLRX3, CYP4F3 KDM4E 2788/4885GAA 3193/4885ALDH1A1 4213/4885

“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.