SCHEMBL25145672

SCHEMBL25145672

O=S(=O)(c1ccc(C(F)(F)F)cc1F)N1CCC2(CC1)CNC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ PKM P14618 2/20 0.45
▸ CNR2 P34972 4/20 0.44
▸ CYP2C9 P11712 2/20 0.44
▸ TRPV4 Q9HBA0 5/20 0.43
▸ CACNA1B Q00975 2/20 0.41
▸ SPR P35270 1/20 0.39
▸ PLA2G1B P04054 1/20 0.39
▸ ATG4B Q9Y4P1 1/20 0.39
▸ CXCR3 P49682 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ GBA1 P04062 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ GAA P10253 1/20 0.38

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
SCHEMBL25941581 0.87 CNR2 (0.38) MEN1KMT2AALDH1A1TSHRATM
SCHEMBL23849998 0.87 TRPV4 (0.46) MEN1KMT2AALDH1A1TSHRATM
SCHEMBL25253376 0.81 CACNA1B (0.48) MEN1KMT2AALDH1A1TSHRATM
SCHEMBL25296539 0.77 F13A1 (0.50) ALDH1A1CACNA1BSPRMAPT
SCHEMBL30409323 0.75 MGLL (0.43) MEN1KMT2AALDH1A1TSHRATM
SCHEMBL25146124 0.75 MGLL (0.43) MEN1KMT2AALDH1A1TSHRATM
SCHEMBL20003548 0.75 TRPV4 (0.52) MEN1KMT2AALDH1A1TSHRATM
SCHEMBL30266709 0.75 TRPV4 (0.52) MEN1KMT2AALDH1A1TSHRATM
SCHEMBL30409788 0.74 MGLL (0.44) PKMCACNA1B
SCHEMBL26064736 0.73 TRPV4 (0.42) MEN1KMT2AALDH1A1TSHRPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4543870-A1 NEW HETEROCYCLIC-CARBONYL-CYCLIC COMPOUNDS AS MAGL INHIBITORS F. Hoffmann-La Roche AG (CH) 2025-04-30 — — EP claimed
WO-2023247670-A1 NEW HETEROCYCLIC-CARBONYL-CYCLIC COMPOUNDS AS MAGL INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2023-12-28 — — WO claimed
US-20250099448-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2025-03-27 — — US disclosed
US-20240383904-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2024-11-21 — — US disclosed
US-11981661-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2024-05-14 — — US disclosed
EP-4208456-A1 HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2023-07-12 — — EP disclosed
WO-2023062049-A1 HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-04-20 — — WO disclosed
CN-115989228-A Heterocyclic compounds 豪夫迈·罗氏有限公司 2023-04-18 — — CN disclosed
US-20220098176-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2022-03-31 — — US 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 (4 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-20220098176-A1 HETEROCYCLIC COMPOUNDS CBR3, BRIX1, CCNY MEN1 1044/4885KMT2A 2194/4885ALDH1A1 1218/4885
US-20240383904-A1 HETEROCYCLIC COMPOUNDS MAGI3, MAG, MAGT1 MEN1 50/4885KMT2A 1833/4885ALDH1A1 1488/4885
US-11981661-B2 Heterocyclic compounds CBR3, BRIX1, CCNY MEN1 1044/4885KMT2A 2194/4885ALDH1A1 1218/4885
US-20250099448-A1 HETEROCYCLIC COMPOUNDS OPRM1, CYP1A1, CYP3A4 MEN1 2422/4885KMT2A 1346/4885ALDH1A1 411/4885

“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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