SCHEMBL23213253

SCHEMBL23213253

Nc1cc(Cl)cc(CN2CCOCC2)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.49
TMEM97 Q5BJF2 3/20 0.48
SIGMAR1 Q99720 3/20 0.48
CYP2A13 Q16696 3/20 0.47
NCF1 P14598 1/20 0.47
NOS1 P29475 2/20 0.47
NOS3 P29474 1/20 0.47
NOS2 P35228 1/20 0.47
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
LRRK2 Q5S007 1/20 0.43
AKR1C3 P42330 1/20 0.43
JAK2 O60674 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
KCNJ1 P48048 1/20 0.42

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
SCHEMBL29796217 1.00 HRH3 (0.51) HRH3L3MBTL1TMEM97SIGMAR1CYP2A13
SCHEMBL30380956 0.83 ALDH1A1 (0.59) HRH3L3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL23239918 0.80 HRH3 (0.51) HRH3L3MBTL1TMEM97SIGMAR1CYP2A13
SCHEMBL30417083 0.80 MAPT (0.49) HRH3CYP2A13NCF1NOS1NOS3
SCHEMBL24197405 0.80 MAPT (0.49) HRH3CYP2A13NCF1NOS1NOS3
SCHEMBL5130191 0.79 NCF1 (0.46) HRH3TMEM97SIGMAR1NCF1MAPT
SCHEMBL60797 0.77 HRH3 (0.71) HRH3CYP2A13NCF1NOS1NOS3
SCHEMBL250720 0.76 NCF1 (0.44) HRH3NCF1NOS1MAPTSMN1; SMN2
SCHEMBL3185946 0.76 MAPT (0.46) HRH3SIGMAR1NCF1NOS1NOS3
SCHEMBL31703336 0.76 NCF1 (0.44) HRH3NCF1NOS1MAPTSMN1; SMN2

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
US-20240216355-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) 2024-07-04 US 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
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
EP-4041231-A1 ISOINDOLINONE COMPOUNDS Monte Rosa Therapeutics AG (CH) 2022-08-17 EP disclosed
US-20220242846-A1 ISOINDOLINONE COMPOUNDS MONTE ROSA THERAPEUTICS AG (CH) 2022-08-04 US disclosed
WO-2021069705-A1 ISOINDOLINONE COMPOUNDS MONTE ROSA THERAPEUTICS (CH) 2021-04-15 WO disclosed
WO-2021069705-A1 ISOINDOLINONE COMPOUNDS MONTE ROSA THERAPEUTICS (CH) 2021-04-15 WO 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 (2 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-20240216355-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 UPF1, NSUN2, RTF2 HRH3 2270/4885L3MBTL1 113/4885TMEM97 3304/4885
US-20220242846-A1 ISOINDOLINONE COMPOUNDS AOC2, AOC3, INF2 HRH3 435/4885L3MBTL1 1858/4885TMEM97 2600/4885

“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.