SCHEMBL29947770

SCHEMBL29947770

Nc1cc(CN2CCOCC2)cc(OC(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ MAPT P10636 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ NCF1 P14598 1/20 0.41
▸ HRH3 Q9Y5N1 6/20 0.41
▸ LMNA P02545 1/20 0.36
▸ NOS1 P29475 2/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ NOS3 P29474 1/20 0.35
▸ NOS2 P35228 1/20 0.35

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
SCHEMBL29177322 0.81 ALDH1A1 (0.45) PDE4BALDH1A1HTTKDM4EHPGD
SCHEMBL27292140 0.81 KCNH2 (0.47) ALDH1A1HTTKDM4EHPGDMAPT
SCHEMBL26739679 0.80 MAPT (0.43) PDE4BALDH1A1HTTKDM4EHPGD
SCHEMBL26741216 0.78 MEN1 (0.48) ALDH1A1HTTKDM4EHRH3
SCHEMBL29177423 0.78 ALDH1A1 (0.53) PDE4BALDH1A1HTTKDM4EHPGD
SCHEMBL29739553 0.78 ALDH1A1 (0.53) PDE4BALDH1A1HTTKDM4EHPGD
SCHEMBL17749783 0.75 MAPT (0.39) PDE4BALDH1A1HTTKDM4EHPGD
SCHEMBL24197405 0.73 MAPT (0.49) ALDH1A1HTTMAPTSMN1; SMN2NCF1
SCHEMBL29796217 0.73 HRH3 (0.51) ALDH1A1MAPTSMN1; SMN2NCF1HRH3
SCHEMBL30417083 0.73 MAPT (0.49) ALDH1A1HTTMAPTSMN1; SMN2NCF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4323349-A1 ISOINDOLINONE AMIDE COMPOUNDS USEFUL TO TREAT DISEASES ASSOCIATED WITH GSPT1 Monte Rosa Therapeutics AG (CH) 2024-02-21 — — EP disclosed
EP-4313047-A1 PHARMACEUTICAL COMPOSITIONS FOR USE IN THE PREVENTION AND TREATMENT OF A DISEASE OR DISORDER CAUSED BY OR ASSOCIATED WITH ONE OR MORE PREMATURE TERMINATION CODONS Monte Rosa Therapeutics, Inc. (US) 2024-02-07 — — EP disclosed
CN-117242060-A Isoindolinone compounds 蒙特罗萨医疗公司 2023-12-15 — — CN disclosed
WO-2022219412-A1 ISOINDOLINONE AMIDE COMPOUNDS USEFUL TO TREAT DISEASES ASSOCIATED WITH GSPT1 MONTE ROSA THERAPEUTICS AG (CH) 2022-10-20 — — WO disclosed
WO-2022200857-A1 PHARMACEUTICAL COMPOSITIONS FOR USE IN THE PREVENTION AND TREATMENT OF A DISEASE OR DISORDER CAUSED BY OR ASSOCIATED WITH ONE OR MORE PREMATURE TERMINATION CODONS MONTE ROSA THERAPEUTICS AG (CH) 2022-09-29 — — WO disclosed
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