SCHEMBL31282954

SCHEMBL31282954

COc1cc(Cl)ccc1N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.47
▸ USP30 Q70CQ3 1/20 0.46
▸ PDE4B Q07343 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ CACNB4 O00305 2/20 0.45
▸ CACNA1A O00555 2/20 0.45
▸ CACNA1G O43497 2/20 0.45
▸ CACNG3 O60359 2/20 0.45
▸ CACNA1F O60840 2/20 0.45
▸ CACNA1H O95180 2/20 0.45
▸ CACNB3 P54284 2/20 0.45
▸ CACNA2D1 P54289 2/20 0.45
▸ CACNG7 P62955 2/20 0.45
▸ CACNA1B Q00975 2/20 0.45
▸ CACNA1D Q01668 2/20 0.45
▸ CACNB1 Q02641 2/20 0.45
▸ CACNG1 Q06432 2/20 0.45
▸ CACNB2 Q08289 2/20 0.45
▸ CACNA1S Q13698 2/20 0.45
▸ CACNA1C Q13936 2/20 0.45

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
SCHEMBL31282832 1.00 MAPT (0.47) MAPTUSP30PDE4BALDH1A1CACNB4
SCHEMBL25388905 1.00 MAPT (0.47) MAPTUSP30PDE4BALDH1A1CACNB4
SCHEMBL31288366 1.00 MAPT (0.47) MAPTUSP30PDE4BALDH1A1CACNB4
SCHEMBL31282640 1.00 MAPT (0.47) MAPTUSP30PDE4BALDH1A1CACNB4
SCHEMBL31282648 0.88 USP30 (0.47) MAPTUSP30ALDH1A1STSMEN1
SCHEMBL31283891 0.88 USP30 (0.47) MAPTUSP30ALDH1A1STSMEN1
SCHEMBL25387627 0.88 STS (0.47) MAPTUSP30ALDH1A1STSMEN1
SCHEMBL31282918 0.88 USP30 (0.47) MAPTUSP30ALDH1A1STSMEN1
SCHEMBL31282658 0.88 USP30 (0.47) MAPTUSP30ALDH1A1STSMEN1
SCHEMBL26274175 0.88 USP30 (0.47) MAPTUSP30ALDH1A1STSMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4472963-A1 DGK TARGETING COMPOUNDS AND USES THEREOF Arvinas Operations, Inc. (US) 2024-12-11 — — EP disclosed
CN-118946556-A DGK targeting compounds and uses thereof 阿维纳斯运营公司 2024-11-12 — — CN disclosed
Send feedback