SCHEMBL25164958

SCHEMBL25164958

Fc1c(Br)c(Cl)cc2c(OCc3ccccc3)nc(Cl)nc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 1/20 0.40
▸ PIN1 Q13526 1/20 0.40
▸ PDE5A O76074 1/20 0.39
▸ ALOX5AP P20292 1/20 0.37
▸ FEN1 P39748 1/20 0.37
▸ MAPK14 Q16539 2/20 0.37
▸ CNR1 P21554 3/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ACHE P22303 2/20 0.35
▸ CNR2 P34972 2/20 0.35
▸ MAOB P27338 1/20 0.34
▸ MPO P05164 1/20 0.33
▸ TPO P07202 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ EPX P11678 1/20 0.33
▸ MGMT P16455 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HRH4 Q9H3N8 1/20 0.33

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
SCHEMBL25165363 0.90 PIN1 (0.40) PTGESPIN1PDE5AALOX5APFEN1
SCHEMBL25336522 0.88 PIN1 (0.39) PTGESPIN1PDE5AALOX5APFEN1
SCHEMBL29936828 0.86 CNR2 (0.38) CNR1CNR2MAOBHRH4
SCHEMBL29343993 0.86 CNR2 (0.38) CNR1CNR2MAOBHRH4
SCHEMBL27209714 0.86 PIN1 (0.37) PTGESPIN1PDE5AALOX5APFEN1
SCHEMBL31041031 0.82 PIN1 (0.41) PTGESPIN1PDE5AALOX5APFEN1
SCHEMBL29071014 0.80 PIN1 (0.41) PTGESPIN1PDE5AALOX5APFEN1
SCHEMBL25337045 0.79 ADORA2A (0.33) —
SCHEMBL23043480 0.79 PIN1 (0.45) PTGESPIN1PDE5AALOX5APFEN1
SCHEMBL25550180 0.78 SCN9A (0.32) CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025101776-A1 HETEROCYCLES AND USES THEREOF KUMQUAT BIOSCIENCES INC. (US) 2025-05-15 — — WO disclosed
US-20250101028-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BEIGENE, LTD. (KY) 2025-03-27 — — US disclosed
EP-4499639-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BeiGene, Ltd. (KY) 2025-02-05 — — EP disclosed
CN-118900838-A Heterocyclic compounds, compositions thereof and methods of treatment thereof 百济神州有限公司 2024-11-05 — — CN disclosed
WO-2024063576-A1 NOVEL QUINAZOLINE COMPOUND AS KRAS INHIBITOR 일동제약(주) 2024-03-28 — — WO disclosed
WO-2023215801-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF KUMQUAT BIOSCIENCES INC. (US) 2023-11-09 — — WO disclosed
WO-2023179703-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BEIGENE , LTD. (KY) 2023-09-28 — — WO disclosed
WO-2023061294-A1 NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE REGULATOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 再鼎医药(上海)有限公司 2023-04-20 — — 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-20250101028-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH KRAS, NRAS, HRAS PTGES 2902/4885PIN1 722/4885PDE5A 3770/4885

“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.

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