SCHEMBL9486252

SCHEMBL9486252

C[C@H](N)COCC(=O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL9486823 1.00
SCHEMBL9486813 1.00
Hydrochloric Acid SCHEMBL23296786 0.98 GABRP (0.43)
Hydrochloric Acid SCHEMBL23296788 0.98 GABRP (0.43)
SCHEMBL9486312 0.82 THPO (0.37)
SCHEMBL9487885 0.82 THPO (0.37)
SCHEMBL9486317 0.82 THPO (0.37)
SCHEMBL2952521 0.80
SCHEMBL25095512 0.79
SCHEMBL9488694 0.79 SLC7A5 (0.43)

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-11691969-B2 Pyridazinones as PARP7 inhibtors RIBON THERAPEUTICS, INC. (US) 2023-07-04 US disclosed
US-11691969-B2 Pyridazinones as PARP7 inhibtors RIBON THERAPEUTICS, INC. (US) 2023-07-04 US disclosed
US-20210130342-A1 PYRIDAZINONES AS PARP7 INHIBITORS ANKURA TRUST COMPANY, LLC, AS COLLATERAL TRUSTEE 2021-05-06 US disclosed
WO-2021087025-A1 PYRIDAZINONES AS PARP7 INHIBITORS RIBON THERAPEUTICS, INC. (US) 2021-05-06 WO disclosed
EP-0350002-B1 DIPHOSPHONIC-ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THOSE COMPOUNDS Roche Diagnostics GmbH (DE) 1993-01-13 EP disclosed
US-5002937-A Diphosphonic acid alkyloxyalkylamines for bone disorders BOEHRINGER MANNHEIM GMBH (DE) 1991-03-26 US disclosed
EP-0350002-A1 Diphosphonic-acid derivatives, process for their preparation and medicines containing those compounds Roche Diagnostics GmbH (DE) 1990-01-10 EP disclosed