SCHEMBL3794396

SCHEMBL3794396

CCCO[Al](OCCC)OCCC.[LiH]

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
SCHEMBL107046 0.96 CA1 (0.30)
SCHEMBL6104435 0.93
SCHEMBL3981221 0.93
SCHEMBL3981218 0.93
SCHEMBL6104433 0.90
Lithium Ion SCHEMBL3794395 0.90
SCHEMBL5956692 0.87
SCHEMBL31135471 0.84 ADRB2 (0.41)
Diethylamine SCHEMBL27875040 0.82 TP53 (0.44)
SCHEMBL5090577 0.80 ADRB2 (0.43)

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE39151-E1 Process for the preparation and purification of thiol-containing maytansinoids IMMUNOGEN, INC. (US) 2006-06-27 US claimed
EP-1313738-B1 PROCESS FOR THE PREPARATION AND PURIFICATION OF THIOL-CONTAINING MAYTANSINOIDS IMMUNOGEN INC (US) 2005-12-21 EP claimed
EP-1313738-A4 PROCESS FOR THE PREPARATION AND PURIFICATION OF THIOL-CONTAINING MAYTANSINOIDS IMMUNOGEN INC (US) 2005-01-19 EP claimed
EP-1313738-A1 PROCESS FOR THE PREPARATION AND PURIFICATION OF THIOL-CONTAINING MAYTANSINOIDS Immunogen, Inc. (US) 2003-05-28 EP claimed
WO-2002016368-A1 PROCESS FOR THE PREPARATION AND PURIFICATION OF THIOL-CONTAINING MAYTANSINOIDS IMMUNOGEN, INC. (US) 2002-02-28 WO claimed
US-6333410-B1 REDUCTIVE HYDROLYSIS OF C3 ESTER WITH LITHIUM TRIMETHOXYALUMINUM HYDRIDE TO YIELD THE MANTANSINOL; ESTERIFYING THE A DISULFIDE-CONTAINING CARBOXYLIC ACID; REDUCING TO YIELD A THIOL-CONTAINING MAYTANSINOID IMMUNOGEN, INC. 2001-12-25 US claimed
WO-2016018934-A1 BIOMARKERS AND MORPHOLOGY BASED APTAMER SELECTION OF SAME COMPANION DX REFERENCE LAB, LLC (TEXAS) (US) 2016-02-04 WO disclosed
US-7767803-B2 Stabilized aptamers to PSMA and their use as prostate cancer therapeutics ARCHEMIX CORP. (US) 2010-08-03 US disclosed
US-20090105172-A1 Stabilized Aptamers to PSMA and Their Use as Prostate Cancer Therapeutics ARCHEMIX CORP. 2009-04-23 US disclosed
EP-1863828-A2 STABILIZED APTAMERS TO PSMA AND THEIR USE AS PROSTATE CANCER THERAPEUTICS Archemix Corp. (US) 2007-12-12 EP disclosed
EP-1756318-A2 APTAMER-TOXIN MOLECULES AND METHOD FOR USING SAME Archemix Corporation (US) 2007-02-28 EP disclosed
US-20070041901-A1 Stabilized aptamers to PSMA and their use as prostate cancer therapeutics ARCHEMIX CORP. 2007-02-22 US disclosed
WO-2006096754-A2 STABILIZED APTAMERS TO PSMA AND THEIR USE AS PROSTATE CANCER THERAPEUTICS ARCHEMIX CORP. (US) 2006-09-14 WO disclosed
EP-1313738-A1 PROCESS FOR THE PREPARATION AND PURIFICATION OF THIOL-CONTAINING MAYTANSINOIDS Immunogen, Inc. (US) 2003-05-28 EP disclosed
US-20020156274-A1 Process for preparing maytansinol SMITHKLINE BEECHAM CORPORATION 2002-10-24 US disclosed
WO-2002074775-A1 PROCESS FOR PREPARING MAYTANSINOL SMITHKLINE BEECHAM CORPORATION (US) 2002-09-26 WO disclosed
WO-2002016368-A1 PROCESS FOR THE PREPARATION AND PURIFICATION OF THIOL-CONTAINING MAYTANSINOIDS IMMUNOGEN, INC. (US) 2002-02-28 WO disclosed
WO-2002016368-A1 PROCESS FOR THE PREPARATION AND PURIFICATION OF THIOL-CONTAINING MAYTANSINOIDS IMMUNOGEN, INC. (US) 2002-02-28 WO disclosed
US-6333410-B1 REDUCTIVE HYDROLYSIS OF C3 ESTER WITH LITHIUM TRIMETHOXYALUMINUM HYDRIDE TO YIELD THE MANTANSINOL; ESTERIFYING THE A DISULFIDE-CONTAINING CARBOXYLIC ACID; REDUCING TO YIELD A THIOL-CONTAINING MAYTANSINOID IMMUNOGEN, INC. 2001-12-25 US disclosed
US-6333410-B1 REDUCTIVE HYDROLYSIS OF C3 ESTER WITH LITHIUM TRIMETHOXYALUMINUM HYDRIDE TO YIELD THE MANTANSINOL; ESTERIFYING THE A DISULFIDE-CONTAINING CARBOXYLIC ACID; REDUCING TO YIELD A THIOL-CONTAINING MAYTANSINOID IMMUNOGEN, INC. 2001-12-25 US disclosed