SCHEMBL21453025

SCHEMBL21453025

CC(=O)NCC(C)CN

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
SCHEMBL21452947 1.00
SCHEMBL10062233 0.85 MTNR1A (0.44)
SCHEMBL14801544 0.81
SCHEMBL19442769 0.81
SCHEMBL29240481 0.81
SCHEMBL28518601 0.81
SCHEMBL19131288 0.80 GABBR2 (0.39)
SCHEMBL18085365 0.79 PAOX (0.48)
SCHEMBL14549906 0.78 CACNA2D1 (0.35)
SCHEMBL22273185 0.78

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-20230357133-A1 NANOMATERIALS COMPRISING CARBONATES BEAM THERAPEUTICS INC. 2023-11-09 US disclosed
EP-4262818-A1 NANOMATERIALS COMPRISING CARBONATES Beam Therapeutics Inc. (US) 2023-10-25 EP disclosed
CN-116685332-A Nanomaterial comprising carbonate 比姆医疗股份有限公司 2023-09-01 CN disclosed
WO-2022140239-A1 NANOMATERIALS COMPRISING CARBONATES BEAM THERAPEUTICS INC. (US) 2022-06-30 WO disclosed
WO-2019193516-A2 SUBSTITUTED PYRIDINE AND PYRIMIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2019-10-10 WO disclosed