SCHEMBL4504376

SCHEMBL4504376

C=[Zr](C1=CC=CC1)(c1ccc(I)cc1)(c1ccc(I)cc1)c1c2c(cc(C(C)(C)C)c1C(C)(C)C)-c1cc(C(C)(C)C)c(C(C)(C)C)cc1C2

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
Hydrochloric Acid SCHEMBL400447 0.99
SCHEMBL6047552 0.91
Hydrochloric Acid SCHEMBL811862 0.90
Hydrochloric Acid SCHEMBL811293 0.90
Hydrochloric Acid SCHEMBL401711 0.89
Hydrochloric Acid SCHEMBL401633 0.89
SCHEMBL18142150 0.88
Hydrochloric Acid SCHEMBL27167617 0.88
Hydrochloric Acid SCHEMBL4954533 0.87
Hydrochloric Acid SCHEMBL399106 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2085420-A1 POLYPROPYLENE RESIN FILM AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2009-08-05 EP disclosed