SCHEMBL30004378

SCHEMBL30004378

N=C=O.[2H]CCC(C)CC[2H]

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
SCHEMBL2831222 0.79 TSHR (0.32)
Methane SCHEMBL28070355 0.77 TSHR (0.30)
SCHEMBL29447129 0.76
SCHEMBL5696405 0.69 TSHR (0.33)
SCHEMBL834041 0.69
SCHEMBL11222121 0.69
Isobutane SCHEMBL3986587 0.67
Isobutane SCHEMBL7910872 0.67
Isobutane SCHEMBL11409032 0.67
SCHEMBL10746089 0.65 TSHR (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4341329-A1 DEGRADABLE COMPOSITE AND METHOD OF FABRICATION 206 ORTHO, INC. (US) 2024-03-27 EP disclosed
EP-4337720-A2 DEGRADABLE COMPOSITE AND METHOD OF FABRICATION 206 Ortho, Inc. (US) 2024-03-20 EP disclosed
WO-2022246122-A1 DEGRADABLE COMPOSITE AND METHOD OF FABRICATION 206 ORTHO, INC. (US) 2022-11-24 WO disclosed
WO-2022241150-A2 DEGRADABLE COMPOSITE AND METHOD OF FABRICATION 206 ORTHO, INC. (US) 2022-11-17 WO disclosed