SCHEMBL1820997

SCHEMBL1820997

CCC1=C([Ti]C2=C(CC)C=CC2)CC=C1

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
Fluoride SCHEMBL1130798 0.98
Hydrochloric Acid SCHEMBL28388695 0.98
Hydrochloric Acid SCHEMBL395520 0.98
Hydrochloric Acid SCHEMBL16949834 0.96
SCHEMBL1820056 0.82
SCHEMBL4576209 0.81
Hydrochloric Acid SCHEMBL715260 0.80
Fluoride SCHEMBL1130452 0.80
SCHEMBL4871080 0.80
SCHEMBL1820106 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7700694-B2 Catalyst composition and method for hydrogenating a polymer having a conjugated diene TSRC CORPORATION (TW) 2010-04-20 US claimed
US-20070254802-A1 Catalyst composition and method for hydrogenating a polymer having a conjugated diene TSRC CORPORATION (TW) 2007-11-01 US claimed
CN-114174356-B Polymerization catalyst for producing high molecular weight polyethylene 陶氏环球技术有限责任公司 2024-07-02 CN disclosed
EP-3327041-B1 PROCESS AND CATALYST COMPOSITION FOR PRODUCING SELECTIVELY HYDROGENATED CONJUGATED DIENE POLYMER TSRC CORP (TW) 2024-04-10 EP disclosed
US-11208505-B2 Process and catalyst composition for producing selectively hydrogenated conjugated diene polymer TSRC CORPORATION (TW) 2021-12-28 US disclosed
US-20200223952-A1 PROCESS AND CATALYST COMPOSITION FOR PRODUCING SELECTIVELY HYDROGENATED CONJUGATED DIENE POLYMER TSRC CORPORATION (TW) 2020-07-16 US disclosed
US-10590209-B2 Process and catalyst composition for producing selectively hydrogenated conjugated diene polymer TSRC CORPORATION (TW) 2020-03-17 US disclosed
US-20180148520-A1 PROCESS AND CATALYST COMPOSITION FOR PRODUCING SELECTIVELY HYDROGENATED CONJUGATED DIENE POLYMER TSRC CORP (TW) 2018-05-31 US disclosed
EP-3327041-A1 PROCESS AND CATALYST COMPOSITION FOR PRODUCING SELECTIVELY HYDROGENATED CONJUGATED DIENE POLYMER TSRC Corporation (TW) 2018-05-30 EP disclosed
US-9181356-B2 Hydrogenation catalyst composition and hydrogenation method thereof TSRC CORPORATION (TW) 2015-11-10 US disclosed
EP-2316862-B1 Hydrogenation catalyst composition and hydrogenation method thereof TSRC CORP (TW) 2013-12-25 EP disclosed
CN-101829600-B Hydrogenation catalyst composition and hydrogenation method thereof TSRC CORP 2012-08-29 CN disclosed
US-20110105694-A1 HYDROGENATION CATALYST COMPOSITION AND HYDROGENATION METHOD THEREOF TSRC CORPORATION (TW) 2011-05-05 US disclosed
EP-2316862-A1 Hydrogenation catalyst composition and hydrogenation method thereof TSRC Corporation (TW) 2011-05-04 EP disclosed
CN-101829600-A Hydrogenation catalyst composition and hydrogenation method thereof TSRC CORP 2010-09-15 CN disclosed
US-7700694-B2 Catalyst composition and method for hydrogenating a polymer having a conjugated diene TSRC CORPORATION (TW) 2010-04-20 US disclosed
US-7612148-B2 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2009-11-03 US disclosed
US-20080146733-A1 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2008-06-19 US disclosed
US-20070254802-A1 Catalyst composition and method for hydrogenating a polymer having a conjugated diene TSRC CORPORATION (TW) 2007-11-01 US disclosed
CN-1721458-A Process for producing catalyst component for addition polymerization, and addition polymer SUMITOMO CHEMICAL CO (JP) 2006-01-18 CN disclosed