SCHEMBL10607100

SCHEMBL10607100

C1=CC([Zr]2([C@@H]3C=CC4=C3CCCC4)CC2)C2=C1CCCC2

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
SCHEMBL8420767 1.00
SCHEMBL812615 1.00
Bromide SCHEMBL6904659 0.98
Hydrochloric Acid SCHEMBL10456231 0.98
Hydrochloric Acid SCHEMBL60123 0.98
Hydrochloric Acid SCHEMBL10456417 0.98
Hydrochloric Acid SCHEMBL2877935 0.98
Fluoride SCHEMBL7595461 0.98
Hydrochloric Acid SCHEMBL5599450 0.91
Alcohol SCHEMBL7540710 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0197319-B1 PROCESS FOR PREPARING OPTICALLY ACTIVE POLYOLEFINES HOECHST AKTIENGESELLSCHAFT (DE) 1989-10-18 EP claimed
EP-0197319-B1 PROCESS FOR PREPARING OPTICALLY ACTIVE POLYOLEFINES HOECHST AKTIENGESELLSCHAFT (DE) 1989-10-18 EP disclosed