SCHEMBL4633203

SCHEMBL4633203

C=CCC(C)(C)C.C=CCC(CC)CC

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
SCHEMBL73307 0.83
Water SCHEMBL26127007 0.80
Hydrochloric Acid SCHEMBL28456441 0.78 TSHR (0.32)
SCHEMBL5608116 0.77
SCHEMBL23929 0.77
SCHEMBL12095222 0.76
SCHEMBL7214851 0.74
SCHEMBL8888025 0.73
SCHEMBL8769922 0.72
SCHEMBL6131297 0.70

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
EP-1524294-B1 THERMOPLASTIC RESIN COMPOSITION, POLYMER COMPOSITION, AND MOLDED OBJECT OBTAINED FROM THE COMPOSITION MITSUI CHEMICALS INC (JP) 2008-05-28 EP disclosed
EP-1911802-A2 Thermoplastic resin composition, polymer composition, and molded object obtained from the composition Mitsui Chemicals, Inc. (JP) 2008-04-16 EP disclosed
US-7196130-B2 Thermoplastic resin composition, polymer composition, and molded product comprising the composition MITSUI CHEMICALS, INC. (JP) 2007-03-27 US disclosed
US-20050131129-A1 Thermoplastic resin composition, polymer composition, and molded object obtrained from the composition MITSUI CHEMICALS, INC. (JP) 2005-06-16 US disclosed
EP-1524294-A1 THERMOPLASTIC RESIN COMPOSITION, POLYMER COMPOSITION, AND MOLDED OBJECT OBTAINED FROM THE COMPOSITION Mitsui Chemicals, Inc. (JP) 2005-04-20 EP disclosed