SCHEMBL2146347

SCHEMBL2146347

C=Cc1ccccc1Cc1ccccc1N

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
AR P10275 1/20 0.36
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
FDPS P14324 1/20 0.33
HSPA5 P11021 1/20 0.32
TSHR P16473 2/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SLC6A3 Q01959 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
POLB P06746 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
SCHEMBL50299 0.87 ALDH1A1 (0.48) ALDH1A1HSPA5TSHRMEN1KMT2A
SCHEMBL36019 0.80 CYP3A4 (0.53) ALDH1A1ARCYP3A4ALOX15CASP1
SCHEMBL29373097 0.80 CYP3A4 (0.53) ALDH1A1ARCYP3A4ALOX15CASP1
SCHEMBL9719138 0.78 CYP3A4 (0.50) ALDH1A1ARCYP3A4ALOX15CASP1
Hydrochloric Acid SCHEMBL11743462 0.78 CYP3A4 (0.50) ALDH1A1ARCYP3A4ALOX15CASP1
Ammonia Solution, Strong SCHEMBL9517239 0.78 CYP3A4 (0.50) ALDH1A1ARCYP3A4ALOX15CASP1
SCHEMBL1759362 0.78 CYP3A4 (0.50) ALDH1A1ARCYP3A4ALOX15CASP1
SCHEMBL31293839 0.78 ALDH1A1 (0.40) ALDH1A1HSPA5TSHR
SCHEMBL454171 0.77 ALDH1A1 (0.46) ALDH1A1CYP3A4TSHRL3MBTL1
SCHEMBL16334906 0.76 GABRA1 (0.40) ALDH1A1HSPA5MEN1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1001816-A4 PERFLUORINATED-ETHER COMPOSITIONS AS DIAGNOSTIC CONTRAST AGENTS IMARX PHARMACEUTICAL CORP (US) 2002-07-17 EP claimed
EP-1001816-A1 PERFLUORINATED-ETHER COMPOSITIONS AS DIAGNOSTIC CONTRAST AGENTS IMARX PHARMACEUTICAL CORP. (US) 2000-05-24 EP claimed
WO-1998023298-A1 PERFLUORINATED-ETHER COMPOSITIONS AS DIAGNOSTIC CONTRAST AGENTS IMARX PHARMACEUTICAL CORP. (US) 1998-06-04 WO claimed
EP-3129464-A2 METHODS, COMPOSITIONS, AND SYSTEMS FOR ACTIVATION AND EXPANSION OF CELLS The Trustees of Columbia University in the City of New York (US) 2017-02-15 EP disclosed
WO-2015157664-A2 METHODS, COMPOSITIONS, AND SYSTEMS FOR ACTIVATION AND EXPANSION OF CELLS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2015-10-15 WO disclosed
WO-2011087521-A1 CHEMILUMINESCENT DYES AND DYE-STAINED PARTICLES UNIVERSITY OF NOTRE DAME DU LAC (US) 2011-07-21 WO disclosed
EP-0930844-B8 IMPROVED METHODS FOR DIAGNOSTIC IMAGING BY REGULATING THE ADMINISTRATION RATE OF A CONTRAST AGENT LANTHEUS MEDICAL IMAGING INC (US) 2008-11-26 EP disclosed
EP-0959908-A4 NOVEL TARGETED CONTRAST AGENTS FOR DIAGNOSTIC AND THERAPEUTIC USE IMARX PHARMACEUTICAL CORP (US) 2002-11-20 EP disclosed
EP-0988061-A4 METHODS FOR DELIVERING BIOACTIVE AGENTS IMARX PHARMACEUTICAL CORP (US) 2002-05-02 EP disclosed
EP-0930844-A4 IMPROVED METHODS FOR DIAGNOSTIC IMAGING BY REGULATING THE ADMINISTRATION RATE OF A CONTRAST AGENT IMARX PHARMACEUTICAL CORP (US) 2002-03-13 EP disclosed
EP-1146911-A2 NOVEL METHODS OF IMAGING AND TREATMENT WITH TARGETED COMPOSITIONS IMARX PHARMACEUTICAL CORP. (US) 2001-10-24 EP disclosed
WO-1999013919-A1 NOVEL TARGETED CONTRAST AGENTS FOR DIAGNOSTIC AND THERAPEUTIC USE IMARX PHARMACEUTICAL CORP. (US) 1999-03-25 WO disclosed
WO-1998050040-A1 NOVEL LIPID SOLUBLE STEROID PRODRUGS IMARX PHARMACEUTICAL CORP. (US) 1998-11-12 WO disclosed
WO-1998050041-A1 NOVEL PRODRUGS COMPRISING FLUORINATED AMPHIPHILES IMARX PHARMACEUTICAL CORP. (US) 1998-11-12 WO disclosed
WO-1998048838-A1 COMPOUNDS NYCOMED IMAGING AS (NO) 1998-11-05 WO disclosed
WO-1998042384-A1 METHODS FOR DELIVERING BIOACTIVE AGENTS IMARX PHARMACEUTICAL CORP. (US) 1998-10-01 WO disclosed
EP-0831932-A1 NOVEL TARGETED COMPOSITIONS FOR DIAGNOSTIC AND THERAPEUTIC USE IMARX PHARMACEUTICAL CORP. (US) 1998-04-01 EP disclosed
WO-1997048337-A1 IMPROVED METHODS FOR DIAGNOSTIC IMAGING BY REGULATING THE ADMINISTRATION RATE OF A CONTRAST AGENT IMARX PHARMACEUTICAL CORP. (US) 1997-12-24 WO disclosed
WO-1996040285-A1 NOVEL TARGETED COMPOSITIONS FOR DIAGNOSTIC AND THERAPEUTIC USE IMARX PHARMACEUTICAL CORP. (US) 1996-12-19 WO disclosed
US-4309327-A COATINGS, PIGMENT PASTES NIPPON PAINT CO., LTD. (JP) 1982-01-05 US disclosed