SCHEMBL25323578

SCHEMBL25323578

O=C(N1CC2(CC(c3nnc(C4CC4)[nH]3)C2)C1)N1CC2(C1)CN(S(=O)(=O)c1ccc(F)cc1C(F)(F)F)C2

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.42
▸ TRPV4 Q9HBA0 1/20 0.38
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ SPR P35270 1/20 0.34
▸ MGLL Q99685 3/20 0.34
▸ RBP4 P02753 4/20 0.34
▸ CACNA1B Q00975 1/20 0.33
▸ HSD11B1 P28845 1/20 0.32
▸ PDE2A O00408 3/20 0.32
▸ PKM P14618 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ ABHD6 Q9BV23 1/20 0.31
▸ HCRTR1 O43613 1/20 0.31
▸ HCRTR2 O43614 1/20 0.31
▸ GPR183 P32249 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
SCHEMBL25326196 0.89 AKR1C3 (0.39) KMT2ASPRPKM
SCHEMBL25325494 0.88 KMT2A (0.43) MEN1KMT2A
SCHEMBL25324751 0.87 EPHX2 (0.41) EPHX2TRPV4KMT2ASPRMGLL
SCHEMBL25326395 0.84 CACNA1B (0.35) MEN1KMT2AMGLLCACNA1B
SCHEMBL25328161 0.81 GPR183 (0.47) MGLLGPR183
SCHEMBL25328257 0.81 CNR1 (0.40) MEN1KMT2AMGLLCACNA1B
SCHEMBL25324457 0.81 GAA (0.39) EPHX2TRPV4MEN1KMT2AMGLL
SCHEMBL27154085 0.80 MGLL (0.55) EPHX2TRPV4SPRMGLLRBP4
SCHEMBL25322792 0.80 AKR1C3 (0.42) SPRMGLLHSD11B1PDE2AABHD6
SCHEMBL25325924 0.80 MGLL (0.44) EPHX2MGLLGPR183

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 EPHX2 292/4885TRPV4 2033/4885MEN1 2422/4885

“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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