Isobutane

Isobutane

SCHEMBL3201171

CC(C)C.O=P(O)(O)F

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

⚠ 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
SCHEMBL28706433 0.85
Phosphoric Acid SCHEMBL571124 0.82 CA2 (0.50)
Phosphoric Acid SCHEMBL5901916 0.82 CA2 (0.50)
Phosphoric Acid SCHEMBL15540730 0.82 CA2 (0.50)
SCHEMBL31402615 0.82 CA2 (0.46)
SCHEMBL2486859 0.82 CA2 (0.46)
SCHEMBL88352 0.82
SCHEMBL634685 0.82 CA2 (0.46)
SCHEMBL21611195 0.80
SCHEMBL18603886 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-7736664-B2 Polymeric composition acting as barrier to noxious agents Stedfast, Inc. (CA) 2010-06-15 US disclosed
US-20100032084-A1 Polymeric composition acting as barrier to noxious agents Stedfast, Inc. 2010-02-11 US disclosed
CN-100490926-C Protective hoods and neck seals for use therein MINE SAFETY APPLIANCES CO (US) 2009-05-27 CN disclosed
EP-1700620-A2 Polymeric composition acting as barrier to noxious agents STEDFAST INC. (CA) 2006-09-13 EP disclosed
CN-1652846-A Protective hoods and neck seals for use therein MINE SAFETY APPLIANCES CO (US) 2005-08-10 CN disclosed