SCHEMBL21521287

SCHEMBL21521287

COC(=O)C1CCCC(OC[C@@H]2CCCN2C(=O)O)C1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 9/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TP53 P04637 1/20 0.35
POLB P06746 2/20 0.34
OPRK1 P41145 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.32
HSD11B1 P28845 1/20 0.32

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
SCHEMBL21522306 0.91 HCRTR2 (0.38) HCRTR2SMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL30101457 0.85 SMN1; SMN2 (0.40) HCRTR2SMN1; SMN2ALDH1A1MAPTHSD17B10
SCHEMBL28530071 0.78 SMN1; SMN2 (0.33) SMN1; SMN2ALDH1A1MAPTHPGDNPSR1
SCHEMBL28522218 0.76 SMN1; SMN2 (0.42) HCRTR2SMN1; SMN2ALDH1A1NPSR1HSD17B10
SCHEMBL21522575 0.74 ALDH1A1 (0.44) HCRTR2SMN1; SMN2ALDH1A1MAPTNPSR1
SCHEMBL3830067 0.74 F2 (0.41) HCRTR2ALDH1A1POLBL3MBTL1
SCHEMBL13191752 0.73 GAA (0.40) SMN1; SMN2ALDH1A1TP53POLB
SCHEMBL3182268 0.73 POLB (0.44) POLBL3MBTL1
SCHEMBL3178302 0.73 POLB (0.44) POLBL3MBTL1
SCHEMBL3178313 0.73 POLB (0.44) POLBL3MBTL1

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 10 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-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 (7 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 HCRTR2 4717/4885SMN1; SMN2 4309/4885ALDH1A1 1033/4885
US-10550105-B2 Pyridazinones as PARP7 inhibitors PARP2, PARP1, PARP4 HCRTR2 4717/4885SMN1; SMN2 4309/4885ALDH1A1 1033/4885
US-20190330194-A1 PYRIDAZINONES AS PARP7 INHIBITORS PARP2, PARP1, PARP4 HCRTR2 4717/4885SMN1; SMN2 4309/4885ALDH1A1 1033/4885
US-11014913-B2 Pyridazinones as PARP7 inhibitors PARP2, PARP1, PARP4 HCRTR2 4717/4885SMN1; SMN2 4309/4885ALDH1A1 1033/4885
US-10870641-B2 Pyridazinones as PARP7 inhibitors PARP2, PARP1, PARP4 HCRTR2 4717/4885SMN1; SMN2 4309/4885ALDH1A1 1033/4885
US-20230192664-A1 PYRIDAZINONES AS PARP7 INHIBITORS PARP2, PARP1, PARP4 HCRTR2 4717/4885SMN1; SMN2 4309/4885ALDH1A1 1033/4885
US-20200123134-A1 PYRIDAZINONES AS PARP7 INHIBITORS PARP2, PARP1, PARP4 HCRTR2 4717/4885SMN1; SMN2 4309/4885ALDH1A1 1033/4885

“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.