SCHEMBL21521768

SCHEMBL21521768

COC(=O)c1cccc(OC(C)[C@@H]2C[C@@H](O[Si](C)(C)C(C)(C)C)CN2C(=O)O)c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 2/20 0.37
ALDH1A1 P00352 1/20 0.35
CHRNB4 P30926 2/20 0.34
CHRNA3 P32297 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDM4E B2RXH2 2/20 0.34
CYSLTR1 Q9Y271 1/20 0.34
GAA P10253 1/20 0.34
EPHX2 P34913 1/20 0.34
TP53 P04637 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ROCK2 O75116 1/20 0.33
PPARG P37231 2/20 0.33
VDR P11473 1/20 0.33

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
SCHEMBL21521010 0.81 CYSLTR1 (0.40) NR1H4KDM4ECYSLTR1SMN1; SMN2PPARG
SCHEMBL21521769 0.80 HCRTR1 (0.40) NR1H4ALDH1A1KDM4ECYSLTR1SMN1; SMN2
SCHEMBL30101468 0.74 CYSLTR1 (0.38) NR1H4KDM4ECYSLTR1PPARGVDR
SCHEMBL1003539 0.74 PIK3CD (0.36)
SCHEMBL30101401 0.73 HCRTR1 (0.38) NR1H4ALDH1A1KDM4ECYSLTR1EPHX2
SCHEMBL28522052 0.70 BTN3A1 (0.33) ALDH1A1L3MBTL1
SCHEMBL4346540 0.69 L3MBTL1 (0.50) ALDH1A1L3MBTL1CYSLTR1TP53SMN1; SMN2
SCHEMBL754910 0.69 SMN1; SMN2 (0.52) ALDH1A1L3MBTL1KDM4EGAAEPHX2
SCHEMBL4299042 0.68 ABHD6 (0.36) L3MBTL1
SCHEMBL10145139 0.68 GAA (0.45) ALDH1A1L3MBTL1KDM4EGAATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4234551-A2 PYRIDAZINONES AS PARP7 INHIBITORS Ribon Therapeutics Inc. (US) 2023-08-30 EP disclosed
US-20230192664-A1 PYRIDAZINONES AS PARP7 INHIBITORS ANKURA TRUST COMPANY, LLC, AS COLLATERAL TRUSTEE 2023-06-22 US disclosed
EP-3788040-B1 PYRIDAZINONES AS PARP7 INHIBITORS RIBON THERAPEUTICS INC (US) 2023-04-12 EP disclosed
US-11566020-B1 Pyridazinones as PARP7 inhibitors RIBON THERAPEUTICS, INC. (US) 2023-01-31 US disclosed
US-11014913-B2 Pyridazinones as PARP7 inhibitors RIBON THERAPEUTICS, INC. (US) 2021-05-25 US disclosed
EP-3788040-A1 PYRIDAZINONES AS PARP7 INHIBITORS Ribon Therapeutics Inc. (US) 2021-03-10 EP disclosed
CN-112424188-A Pyridazinones as PARP7 inhibitors 里邦医疗公司 2021-02-26 CN disclosed
US-20210024502-A1 PYRIDAZINONES AS PARP7 INHIBITORS ANKURA TRUST COMPANY, LLC, AS COLLATERAL TRUSTEE 2021-01-28 US disclosed
US-10870641-B2 Pyridazinones as PARP7 inhibitors RIBON THERAPEUTICS, INC. (US) 2020-12-22 US disclosed
US-20200123134-A1 PYRIDAZINONES AS PARP7 INHIBITORS ANKURA TRUST COMPANY, LLC, AS COLLATERAL TRUSTEE 2020-04-23 US disclosed
US-10550105-B2 Pyridazinones as PARP7 inhibitors Ribon Therapeutics Inc. (US) 2020-02-04 US disclosed
US-20190330194-A1 PYRIDAZINONES AS PARP7 INHIBITORS ANKURA TRUST COMPANY, LLC, AS COLLATERAL TRUSTEE 2019-10-31 US 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 (8 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-20210024502-A1 PYRIDAZINONES AS PARP7 INHIBITORS PARP2, PARP1, PARP4 NR1H4 4127/4885ALDH1A1 1033/4885CHRNB4 4609/4885
US-10550105-B2 Pyridazinones as PARP7 inhibitors PARP2, PARP1, PARP4 NR1H4 4127/4885ALDH1A1 1033/4885CHRNB4 4609/4885
US-20190330194-A1 PYRIDAZINONES AS PARP7 INHIBITORS PARP2, PARP1, PARP4 NR1H4 4127/4885ALDH1A1 1033/4885CHRNB4 4609/4885
US-11014913-B2 Pyridazinones as PARP7 inhibitors PARP2, PARP1, PARP4 NR1H4 4127/4885ALDH1A1 1033/4885CHRNB4 4609/4885
US-11566020-B1 Pyridazinones as PARP7 inhibitors PARP2, PARP1, PARP4 NR1H4 4127/4885ALDH1A1 1033/4885CHRNB4 4609/4885
US-10870641-B2 Pyridazinones as PARP7 inhibitors PARP2, PARP1, PARP4 NR1H4 4127/4885ALDH1A1 1033/4885CHRNB4 4609/4885
US-20230192664-A1 PYRIDAZINONES AS PARP7 INHIBITORS PARP2, PARP1, PARP4 NR1H4 4127/4885ALDH1A1 1033/4885CHRNB4 4609/4885
US-20200123134-A1 PYRIDAZINONES AS PARP7 INHIBITORS PARP2, PARP1, PARP4 NR1H4 4127/4885ALDH1A1 1033/4885CHRNB4 4609/4885

“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.