SCHEMBL30965401

SCHEMBL30965401

Brc1cnc2nnn(Cc3ccccc3)c2c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 9/20 0.51
SLC9A1 P19634 1/20 0.50
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
HCAR3 P49019 1/20 0.47
MET P08581 1/20 0.44
ESR1 P03372 1/20 0.44
DYRK1B Q9Y463 1/20 0.43
IDO1 P14902 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
RECQL P46063 1/20 0.40
PTK2 Q05397 1/20 0.39

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
SCHEMBL31057630 0.77 GRM2 (0.50) GRM2SLC9A1KDM4EALDH1A1HCAR3
SCHEMBL19019537 0.72 ESR1 (0.51) KDM4EALDH1A1METESR1DYRK1B
SCHEMBL30965408 0.72 DYRK1B (0.46) GRM2KDM4EALDH1A1METESR1
SCHEMBL17807866 0.71 TNF (0.52) KDM4EALDH1A1METESR1DYRK1B
SCHEMBL16302844 0.69 CYP11B1 (0.47) METESR1MKNK1MKNK2
SCHEMBL19019538 0.69 ESR1 (0.47) ALDH1A1METESR1DYRK1BMKNK1
SCHEMBL18528942 0.68 GRM2 (0.51) GRM2SLC9A1KDM4EALDH1A1HCAR3
SCHEMBL19020226 0.68 ESR1 (0.47) METESR1DYRK1BMKNK1MKNK2
SCHEMBL16498264 0.67 HRH4 (0.45) SLC9A1ALDH1A1HCAR3METDYRK1B
SCHEMBL15243038 0.67 IDO1 (0.54) GRM2SLC9A1KDM4EALDH1A1HCAR3

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-4638437-A1 PHENYLPIPERIDINE DERIVATIVES AS INHIBITORS OF GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE AND GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE LIKE PROTEIN Boehringer Ingelheim International GmbH (DE) 2025-10-29 EP disclosed
US-20240246981-A1 PHENYLPIPERIDINE DERIVATIVES AS INHIBITORS OF GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE AND GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE LIKE PROTEIN BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-07-25 US disclosed
WO-2024133014-A1 PHENYLPIPERIDINE DERIVATIVES AS INHIBITORS OF GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE AND GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE LIKE PROTEIN BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-06-27 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-20240246981-A1 PHENYLPIPERIDINE DERIVATIVES AS INHIBITORS OF GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE AND GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE LIKE PROTEIN QPCT, QPCTL, GGCT GRM2 1141/4885SLC9A1 3010/4885KDM4E 1442/4885

“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.