SCHEMBL25325226

SCHEMBL25325226

O=C(N1CC(NCc2ccc(C(F)(F)F)cc2Cl)C1)N1CC2(CC(c3nnc(C4CC4)[nH]3)C2)C1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.38
▸ PDE2A O00408 1/20 0.36
▸ PPARG P37231 2/20 0.36
▸ P2RX7 Q99572 2/20 0.36
▸ MGLL Q99685 3/20 0.36
▸ TEAD1 P28347 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PDCD1LG2 Q9BQ51 1/20 0.34
▸ CD274 Q9NZQ7 1/20 0.34
▸ CCR2 P41597 3/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ FFAR4 Q5NUL3 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ MCHR1 Q99705 1/20 0.32

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
SCHEMBL25324075 0.93 P2RX7 (0.37) PDE2AP2RX7MGLLTEAD1MEN1
SCHEMBL25325835 0.91 MGLL (0.37) PDE2AMGLLTEAD1MCHR1
SCHEMBL25322265 0.89 POLB (0.39) PDE2AMGLLTEAD1MEN1KMT2A
SCHEMBL25325838 0.88 PDE2A (0.39) PDE2ATEAD1MEN1KMT2APDCD1LG2
SCHEMBL25325418 0.88 MGLL (0.36) PDE2AMGLLTEAD1MEN1KMT2A
SCHEMBL25325112 0.86 TEAD1 (0.44) MGLLTEAD1CCR2MCHR1
SCHEMBL25324564 0.85 ENPP2 (0.38) PDE2AMGLLPDCD1LG2CD274
SCHEMBL25325576 0.85 FAAH (0.36) FAAHP2RX7MGLLPDCD1LG2CD274
SCHEMBL30553285 0.85 FAAH (0.36) FAAHP2RX7MGLLPDCD1LG2CD274
SCHEMBL25324066 0.84 P2RX7 (0.39) P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250099448-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2025-03-27 — — US claimed
EP-4469446-A1 NEW HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-12-04 — — EP claimed
WO-2023144160-A1 NEW HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-08-03 — — WO claimed
US-20250099448-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2025-03-27 — — US disclosed
EP-4469446-A1 NEW HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-12-04 — — EP disclosed
WO-2023144160-A1 NEW HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-08-03 — — 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-20250099448-A1 HETEROCYCLIC COMPOUNDS OPRM1, CYP1A1, CYP3A4 FAAH 451/4885PDE2A 1875/4885PPARG 3387/4885

“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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