SCHEMBL29977899

SCHEMBL29977899

COC(=O)c1nc(C)c(C)nc1N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.56
ALDH1A1 P00352 6/20 0.49
HPGD P15428 3/20 0.49
GAA P10253 3/20 0.49
KDM4E B2RXH2 6/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HSD17B10 Q99714 1/20 0.44
PKM P14618 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 2/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
MAPT P10636 2/20 0.39
RCE1 Q9Y256 1/20 0.39
MEN1 O00255 1/20 0.38
MAPK1 P28482 2/20 0.37
KDM4C Q9H3R0 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL16418573 1.00 NPSR1 (0.56) NPSR1ALDH1A1HPGDGAAKDM4E
SCHEMBL13144986 0.89 NPSR1 (0.54) NPSR1ALDH1A1HPGDGAAKDM4E
SCHEMBL6101682 0.86 NPSR1 (0.75) NPSR1ALDH1A1HPGDGAAKDM4E
SCHEMBL30206694 0.84 NPSR1 (0.48) NPSR1ALDH1A1HPGDGAAKDM4E
SCHEMBL6617911 0.84 NPSR1 (0.48) NPSR1ALDH1A1HPGDGAAKDM4E
SCHEMBL12108294 0.84 NPSR1 (0.48) NPSR1ALDH1A1HPGDGAAKDM4E
SCHEMBL2408256 0.82 NPSR1 (0.61) NPSR1ALDH1A1HPGDGAAKDM4E
SCHEMBL20169647 0.81 ALDH1A1 (0.37) NPSR1ALDH1A1HPGDGAAKDM4E
SCHEMBL5925844 0.80 NPSR1 (0.48) NPSR1ALDH1A1HPGDGAAKDM4E
SCHEMBL19625997 0.79 NPSR1 (0.52) NPSR1ALDH1A1HPGDGAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4673436-A1 INDAZOLE COMPOUNDS AS PKMYT1 KINASE INHIBITORS F. Hoffmann-La Roche AG (CH) 2026-01-07 EP disclosed
EP-4429663-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS Vigil Neuroscience, Inc. (US) 2024-09-18 EP disclosed
WO-2024179948-A1 INDAZOLE COMPOUNDS AS PKMYT1 KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2024-09-06 WO disclosed
EP-4334295-A2 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS AND METHODS OF USE Vigil Neuoscience, Inc. (US) 2024-03-13 EP disclosed
CN-117597333-A Heterocyclic compounds as receptor 2-triggering agonists expressed on myeloid cells and methods of use 维吉尔神经科学股份有限公司 2024-02-23 CN disclosed
WO-2023086799-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS VIGIL NEUROSCIENCE, INC. (US) 2023-05-19 WO disclosed
WO-2022236272-A2 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS AND METHODS OF USE VIGIL NEUROSCIENCE, INC. (US) 2022-11-10 WO disclosed