SCHEMBL1007101

SCHEMBL1007101

CC(C)(C)C=C=[Ru](Cl)(Cl)(=c1n(C2CCCCC2)ccn1C1CCCCC1)=c1n(C2CCCCC2)ccn1C1CCCCC1

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
SCHEMBL1007543 0.79
SCHEMBL1172657 0.74 SLC18A3 (0.33)
SCHEMBL819175 0.64 IL4I1 (0.34)
Tert-Butanol SCHEMBL15058064 0.61 GAA (0.33)
SCHEMBL6402903 0.61
SCHEMBL22188650 0.59 PI4KA (0.33)
Hydrochloric Acid SCHEMBL1007100 0.58
Hydrochloric Acid SCHEMBL6402899 0.58 ALDH1A1 (0.31)
SCHEMBL2801615 0.58 PI4KA (0.32)
SCHEMBL20489211 0.58 SLC18A3 (0.32)

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-2270063-B1 PROCESS FOR PRODUCING HYDROGENATED PRODUCT OF CYCLIC OLEFIN POLYMER PREPARED THROUGH RING-OPENING POLYMERIZATION ZEON CORP (JP) 2016-03-23 EP disclosed
EP-1197509-B1 PROCESS FOR PRODUCING HYDROGENATED RING-OPENING POLYMERIZATION POLYMER OF CYCLOOLEFIN ZEON CORP (JP) 2011-07-06 EP disclosed
EP-2270063-A2 Process for producing hydrogenated product of cyclic olefin polymer prepared through ring-opening polymerization NIPPON ZEON CO., LTD. (JP) 2011-01-05 EP disclosed
EP-1197509-A1 PROCESS FOR PRODUCING HYDROGENATED RING-OPENING POLYMERIZATION POLYMER OF CYCLOOLEFIN Nippon Zeon Co., Ltd. (JP) 2002-04-17 EP disclosed