SCHEMBL23150522

SCHEMBL23150522

CC(C)(C)OC(=O)N1CC2(CC(Cc3ccc(F)cc3F)C2)C1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.42
PARP1 P09874 5/20 0.42
DPP4 P27487 1/20 0.41
BRD3 Q15059 2/20 0.41
HDAC2 Q92769 2/20 0.40
HDAC1 Q13547 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
OXTR P30559 1/20 0.39
AVPR1A P37288 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RORC P51449 1/20 0.38
TNKS O95271 2/20 0.38
TNKS2 Q9H2K2 2/20 0.38
MGLL Q99685 1/20 0.38
ABHD6 Q9BV23 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
SCHEMBL29497028 1.00 GPR119 (0.42) GPR119PARP1DPP4BRD3HDAC2
SCHEMBL31029105 0.89 NR1H2 (0.42) GPR119PARP1DPP4HDAC2HDAC1
SCHEMBL30700681 0.88 EPHX2 (0.43) GPR119BRD3HDAC2HDAC1RORC
SCHEMBL30700632 0.88 RORC (0.42) GPR119PARP1DPP4OXTRAVPR1A
SCHEMBL25252316 0.87 GPR119 (0.48) GPR119BRD3HDAC2HDAC1
SCHEMBL30408922 0.86 GPR119 (0.40) GPR119PARP1DPP4OXTRAVPR1A
SCHEMBL30408969 0.83 GPR119 (0.46) GPR119PARP1DPP4RORC
SCHEMBL4239855 0.83 DPP4 (0.54) GPR119DPP4BRD3SMN1; SMN2
SCHEMBL23150537 0.82 HTR2A (0.40) DPP4SMN1; SMN2ALDH1A1
SCHEMBL27150192 0.81 PARP1 (0.44) GPR119PARP1DPP4OXTRAVPR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4204420-B1 HETEROCYCLIC COMPOUNDS USEFUL AS MAGL INHIBITORS HOFFMANN LA ROCHE (CH) 2024-08-07 EP disclosed
US-20240199587-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2024-06-20 US disclosed
US-11981661-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2024-05-14 US disclosed
EP-4326714-A1 HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-02-28 EP disclosed
WO-2023247670-A1 NEW HETEROCYCLIC-CARBONYL-CYCLIC COMPOUNDS AS MAGL INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2023-12-28 WO disclosed
EP-4208456-A1 HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2023-07-12 EP disclosed
EP-4204420-A1 HETEROCYCLIC COMPOUNDS USEFUL AS MAGL INHIBITORS F. Hoffmann-La Roche AG (CH) 2023-07-05 EP disclosed
US-20230203056-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2023-06-29 US disclosed
WO-2022223750-A1 HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2022-10-27 WO disclosed
EP-4034541-A1 HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2022-08-03 EP disclosed
US-20220106328-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2022-04-07 US disclosed
US-20220098176-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2022-03-31 US disclosed
WO-2021058444-A1 HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2021-04-01 WO disclosed
US-20210094972-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2021-04-01 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 (6 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 GPR119 2316/4885PARP1 397/4885DPP4 3453/4885
US-20240199587-A1 HETEROCYCLIC COMPOUNDS CYP1B1, CYP1A1, CYP4B1 GPR119 1925/4885PARP1 670/4885DPP4 4119/4885
US-11981661-B2 Heterocyclic compounds CBR3, BRIX1, CCNY GPR119 2316/4885PARP1 397/4885DPP4 3453/4885
US-20220106328-A1 HETEROCYCLIC COMPOUNDS CYP1B1, CYP4B1, CYP1A1 GPR119 4041/4885PARP1 519/4885DPP4 3554/4885
US-20230203056-A1 HETEROCYCLIC COMPOUNDS CYP1B1, ZYX, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 GPR119 3062/4885PARP1 373/4885DPP4 3526/4885
US-20210094972-A1 HETEROCYCLIC COMPOUNDS CYP1B1, CYP4B1, CYP1A1 GPR119 4041/4885PARP1 519/4885DPP4 3554/4885

“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.