SCHEMBL2148486

SCHEMBL2148486

CC(CCCCN)NC(C)SP(=O)(O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 3/20 0.35
GABBR1 Q9UBS5 3/20 0.35
BLM P54132 3/20 0.34
DRD3 P35462 1/20 0.34
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
THPO P40225 1/20 0.33
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
THRB P10828 1/20 0.32
CASP1 P29466 1/20 0.32
RAD52 P43351 1/20 0.32
CASP7 P55210 1/20 0.32
CASP6 P55212 1/20 0.32
CASP8 Q14790 1/20 0.32
GSR P00390 1/20 0.32
CYP3A4 P08684 1/20 0.31
NFKB1 P19838 1/20 0.31
PMP22 Q01453 1/20 0.31
CPB2 Q96IY4 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL2148512 0.95 GABBR2 (0.36) GABBR2GABBR1BLMDRD3CYP1A2
SCHEMBL2148324 0.88 GABBR2 (0.42) GABBR2GABBR1BLMDRD3CYP1A2
SCHEMBL2148327 0.77 BLM (0.41) GABBR2GABBR1BLMDRD3CYP1A2
SCHEMBL2148514 0.76 PAOX (0.40) GABBR2GABBR1BLMDRD3CYP1A2
SCHEMBL2148490 0.76 PAOX (0.40) GABBR2GABBR1BLMDRD3CYP1A2
SCHEMBL9564515 0.75 BLM (0.46) GABBR2GABBR1BLMDRD3CYP1A2
SCHEMBL9796748 0.73 NFKB1 (0.39) BLMTSHRLMNAGSRNFKB1
SCHEMBL2148429 0.72 ANPEP (0.39) ALDH1A1TDP1
SCHEMBL2148523 0.71 ANPEP (0.38) GABBR2GABBR1BLMDRD3CYP1A2
SCHEMBL2148521 0.70 LAP3 (0.36) ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130090312-A1 METHODS OF USE RELATED TO XEROSTOMIA MEDIMMUNE LLC (US) 2013-04-11 US disclosed
US-20110166108-A1 METHODS OF USE RELATED TO XEROSTOMIA MEDIMMUNE, LLC. 2011-07-07 US disclosed
US-7629333-B2 Stable amorphous amifostine compositions and methods for the preparation and use of same MEDIMMUNE, LLC (US) 2009-12-08 US disclosed
US-20080027030-A1 Pharmaceutical compositions comprising amifostine and related compounds STOGNIEW MARTIN 2008-01-31 US disclosed
EP-1764103-A2 Crystalline amifostine compositions and methods for the preparation and use of same Medimmune Oncology, Inc. (US) 2007-03-21 EP disclosed
US-7151094-B2 Topical administration of amifostine and related compounds MEDLMMUNE ONCOLOGY, INC. (US) 2006-12-19 US disclosed
US-20060270636-A1 Methods for treatment of neuro- and nephro- disorders and therapeutic toxicities using aminothiol compounds MEDIMMUNE ONCOLOGY, INC. 2006-11-30 US disclosed
US-7105575-B2 Methods for the treatment of neuro- disorders using aminothiol compounds MEDIMMUNE ONCOLOGY INC. (US) 2006-09-12 US disclosed
EP-1039887-B1 USE OF AMINOTHIOL COMPOUNDS FOR THE TREATMENT OF NEURO- AND NEPHRO-DISORDERS AND THERAPEUTIC TOXICITIES MEDIMMUNE ONCOLOGY INC (US) 2006-05-24 EP disclosed
US-20060040903-A1 Methods of use related to xerostomia STOGNIEW MARTIN 2006-02-23 US disclosed
US-20020010357-A1 STABLE AMORPHOUS AMIFOSTINE COMPOSITIONS AND DOSAGE FORM CLINIGEN GROUP PLC (GB) 2002-01-24 US disclosed
US-6239119-B1 PROTECTING MUCOSAL TISSUE FROM DAMAGE ASSOCIATED WITH RADIATION AND/OR CHEMOTHERAPEUTIC TREATMENT OF CANCERS, AVOID THE SIDE EFFECTS OF SYSTEMICALLY APPLIED RADIO/CHEMO PROTECTANTS. MEDIMMUNE ONCOLOGY, INC. 2001-05-29 US disclosed
EP-1039887-A1 METHODS FOR TREATMENT OF NEURO- AND NEPHRO-DISORDERS AND THERAPEUTIC TOXICITIES USING AMINOTHIOL COMPOUNDS U.S. BIOSCIENCE, INC. (US) 2000-10-04 EP disclosed
US-5994409-A Methods for treatment of neuro--and nephro--disorders and therapeutic toxicities using aminothiol compounds U.S. BIOSCIENCE, INC. (US) 1999-11-30 US disclosed
WO-1999029312-A1 METHODS FOR TREATMENT OF NEURO- AND NEPHRO-DISORDERS AND THERAPEUTIC TOXICITIES USING AMINOTHIOL COMPOUNDS U.S. BIOSCIENCE, INC. (US) 1999-06-17 WO disclosed
US-5591731-A Crystalline amifostine compositions U.S. BIOSCIENCE, INC. (US) 1997-01-07 US disclosed
EP-0655917-A4 CRYSTALLINE AMIFOSTINE COMPOSITIONS AND METHODS FOR THE PREPARATION AND USE OF SAME. US BIOSCIENCE (US) 1995-08-02 EP disclosed
US-5424471-A Stabilizing the drug for storage stability, heat resistance by hydrating in an alcohol water solution, vacuum drying to form solid crystals U.S. BIOSCIENCE, INC. (US) 1995-06-13 US disclosed
EP-0655917-A1 CRYSTALLINE AMIFOSTINE COMPOSITIONS AND METHODS FOR THE PREPARATION AND USE OF SAME U.S. BIOSCIENCE, INC. (US) 1995-06-07 EP disclosed
WO-1994003179-A1 CRYSTALLINE AMIFOSTINE COMPOSITIONS AND METHODS FOR THE PREPARATION AND USE OF SAME U.S. BIOSCIENCE, INC. (US) 1994-02-17 WO disclosed