SCHEMBL21522595

SCHEMBL21522595

CCOC(=O)c1ccc(OC[C@@H]2CCCN2C(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 4/20 0.53
CHRNA7 P36544 4/20 0.53
CHRNA4 P43681 4/20 0.53
CHRNA5 P30532 3/20 0.53
ALDH1A1 P00352 1/20 0.51
KCNH2 Q12809 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48
MMP13 P45452 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
HPGD P15428 1/20 0.45
MAPT P10636 1/20 0.44
LTA4H P09960 1/20 0.44
FDFT1 P37268 1/20 0.44
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL2429206 0.85 MEN1 (0.49) CHRNB2CHRNA7CHRNA4CHRNA5ALDH1A1
SCHEMBL28524412 0.85 MEN1 (0.49) CHRNB2CHRNA7CHRNA4CHRNA5ALDH1A1
SCHEMBL28159876 0.85 FFAR1 (0.53) CHRNB2CHRNA4ALDH1A1HRH3LTA4H
SCHEMBL15811746 0.81 ABHD6 (0.54) CHRNB2CHRNA7CHRNA4CHRNA5ALDH1A1
SCHEMBL4140738 0.81 ABHD6 (0.54) CHRNB2CHRNA7CHRNA4CHRNA5ALDH1A1
SCHEMBL16468435 0.80 LTA4H (0.49) CHRNB2CHRNA7CHRNA4ALDH1A1KCNH2
SCHEMBL2258523 0.80 ABHD6 (0.54) LTA4H
SCHEMBL5413716 0.80 FFAR1 (0.55) CHRNB2CHRNA7CHRNA4CHRNA5HRH3
SCHEMBL5539590 0.79 EPHX2 (0.52) HRH3LTA4H
SCHEMBL5539597 0.79 EPHX2 (0.52) HRH3LTA4H

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 11 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
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 CHRNB2 4647/4885CHRNA7 2782/4885CHRNA4 4310/4885
US-10550105-B2 Pyridazinones as PARP7 inhibitors PARP2, PARP1, PARP4 CHRNB2 4647/4885CHRNA7 2782/4885CHRNA4 4310/4885
US-20190330194-A1 PYRIDAZINONES AS PARP7 INHIBITORS PARP2, PARP1, PARP4 CHRNB2 4647/4885CHRNA7 2782/4885CHRNA4 4310/4885
US-11014913-B2 Pyridazinones as PARP7 inhibitors PARP2, PARP1, PARP4 CHRNB2 4647/4885CHRNA7 2782/4885CHRNA4 4310/4885
US-11566020-B1 Pyridazinones as PARP7 inhibitors PARP2, PARP1, PARP4 CHRNB2 4647/4885CHRNA7 2782/4885CHRNA4 4310/4885
US-10870641-B2 Pyridazinones as PARP7 inhibitors PARP2, PARP1, PARP4 CHRNB2 4647/4885CHRNA7 2782/4885CHRNA4 4310/4885
US-20230192664-A1 PYRIDAZINONES AS PARP7 INHIBITORS PARP2, PARP1, PARP4 CHRNB2 4647/4885CHRNA7 2782/4885CHRNA4 4310/4885
US-20200123134-A1 PYRIDAZINONES AS PARP7 INHIBITORS PARP2, PARP1, PARP4 CHRNB2 4647/4885CHRNA7 2782/4885CHRNA4 4310/4885

“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.