SCHEMBL493581

SCHEMBL493581

[CH]1CC2C[CH]CC(C1)C2

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
SCHEMBL687582 0.91
SCHEMBL834366 0.84
SCHEMBL1267181 0.75
SCHEMBL4317503 0.73
SCHEMBL4318976 0.68
SCHEMBL24236 0.67
SCHEMBL4314494 0.67
SCHEMBL4318392 0.65
SCHEMBL4317631 0.65
SCHEMBL13728745 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120149921-A1 TERTIARY ALCOHOL DERIVATIVE, POLYMER COMPOUND AND PHOTORESIST COMPOSITION KURARAY CO., LTD. (JP) 2012-06-14 US claimed
US-8541606-B2 Tertiary alcohol derivative, polymer compound and photoresist composition KURARAY CO., LTD. (JP) 2013-09-24 US disclosed
US-20120149921-A1 TERTIARY ALCOHOL DERIVATIVE, POLYMER COMPOUND AND PHOTORESIST COMPOSITION KURARAY CO., LTD. (JP) 2012-06-14 US disclosed
US-8105746-B2 Tertiary alcohol derivative, polymer compound and photoresist composition KURARAY CO., LTD. (JP) 2012-01-31 US disclosed
EP-2139904-A1 METHOD FOR THE PRODUCTION OF AN ALKENYL PHOSPHONIC ACID DERIVATIVE BASF SE (DE) 2010-01-06 EP disclosed
WO-2009124897-A1 COMPLEX COMPOUND CONTAINING A METAL ATOM AND PHOSPHINE DERIVATIVE AS THE LIGAND BASF SE (DE) 2009-10-15 WO disclosed
US-20090029290-A1 TERTIARY ALCOHOL DERIVATIVE, POLYMER COMPOUND AND PHOTORESIST COMPOSITION KURARAY CO., LTD. (JP) 2009-01-29 US disclosed
EP-1992651-A1 TERTIARY ALCOHOL DERIVATIVE, POLYMER COMPOUND AND PHOTORESIST COMPOSITION Kuraray Co., Ltd. (JP) 2008-11-19 EP disclosed
WO-2008113777-A1 METHOD FOR THE PRODUCTION OF AN ALKENYL PHOSPHONIC ACID DERIVATIVE BASF SE (DE) 2008-09-25 WO disclosed
US-7399876-B2 Preparation of an alkenylphosphonic acid derivative BASF AKTIENGESELLSCHAFT (DE) 2008-07-15 US disclosed
US-6916954-B2 Catalyst system and method for carbonylation BASF AKTIENGESELLSCHAFT (DE) 2005-07-12 US disclosed
US-20050113593-A1 Preparation of an alkenylphosphonic acid derivative BASF AKTIENGESELLSCHAFT (DE) 2005-05-26 US disclosed
US-6723882-B2 Preparation of dialkyl ketones BASF AKTIENGESELLSCHAFT (DE) 2004-04-20 US disclosed
US-20030191339-A1 Catalyst system and method for carbonylation BASF AKTIENGESELLSCHAFT (DE) 2003-10-09 US disclosed
US-20030069450-A1 Preparation of dialkyl ketones BASF AKTIENGESELLSCHAFT (DE) 2003-04-10 US disclosed