SCHEMBL23728682

SCHEMBL23728682

CC(C)(C)OC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOc1ccc([N+](=O)[O-])cn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.45
CNR2 P34972 2/20 0.45
CYP2C19 P33261 2/20 0.44
CA12 O43570 4/20 0.42
CA1 P00915 4/20 0.42
CA2 P00918 4/20 0.42
CA9 Q16790 4/20 0.42
ADRB2 P07550 1/20 0.40
HTR1A P08908 1/20 0.40
BRD4 O60885 1/20 0.40
KDM4E B2RXH2 1/20 0.39
SUCNR1 Q9BXA5 2/20 0.39
EGFR P00533 1/20 0.39
ITK Q08881 1/20 0.39
MEN1 O00255 2/20 0.38
PABPC1 P11940 2/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38
CYP1A2 P05177 1/20 0.38
GAA P10253 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
SCHEMBL30980621 1.00 BCHE (0.45) BCHECNR2CYP2C19CA12CA1
SCHEMBL22371541 1.00 BCHE (0.45) BCHECNR2CYP2C19CA12CA1
SCHEMBL10233481 0.93 CA12 (0.48) CYP2C19CA12CA1CA2CA9
SCHEMBL16980508 0.90 CA12 (0.49) CYP2C19CA12CA1CA2CA9
SCHEMBL31294842 0.89 CA12 (0.50) CYP2C19CA12CA1CA2CA9
SCHEMBL22371611 0.86 MAPT (0.50) BCHECNR2CYP2C19CA12CA1
SCHEMBL30693811 0.84 CA12 (0.57) BCHECNR2CA12CA1CA2
SCHEMBL25987728 0.84 CA12 (0.57) BCHECNR2CA12CA1CA2
SCHEMBL17162067 0.84 CA12 (0.57) BCHECNR2CA12CA1CA2
SCHEMBL22371591 0.84 PPARG (0.43) CYP2C19KDM4EMEN1PABPC1KMT2A

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
US-20240050576-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2024-02-15 US disclosed
US-20230149550-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-05-18 US disclosed
CN-115768765-A Methods and compounds for treating genetic diseases 设计治疗公司 2023-03-07 CN disclosed
EP-4100404-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. (US) 2022-12-14 EP disclosed
WO-2021158707-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. (US) 2021-08-12 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-20230149550-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE DMPK, DTYMK, MYCBP BCHE 4341/4885CNR2 4730/4885CYP2C19 4881/4885
US-20240050576-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE ZFX, GRN, F13B BCHE 4038/4885CNR2 4256/4885CYP2C19 4844/4885

“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.