SCHEMBL4142848

SCHEMBL4142848

CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4CC(OC(=O)CCCCCCCCCCCN(C)c5ccc([N+](=O)[O-])c6nonc56)CC[C@]4(C)C3CC[C@@]21C

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ POLA1 P09884 1/20 0.54
▸ CYP46A1 Q9Y6A2 2/20 0.53
▸ NPC1L1 Q9UHC9 3/20 0.51
▸ NPC1 O15118 1/20 0.51
▸ PLA2G2A P14555 1/20 0.50
▸ USP2 O75604 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ ABCB1 P08183 1/20 0.49
▸ OSBP P22059 1/20 0.49
▸ RORC P51449 1/20 0.49
▸ OSBP2 Q969R2 1/20 0.49
▸ ST6GAL1 P15907 1/20 0.46
▸ ST3GAL1 Q11201 1/20 0.46
▸ NR1H3 Q13133 1/20 0.46
▸ DHCR24 Q15392 1/20 0.46
▸ GBA1 P04062 2/20 0.46
▸ UGCG Q16739 2/20 0.46
▸ GBA2 Q9HCG7 2/20 0.46

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
SCHEMBL31430017 0.89 CYP46A1 (0.54) POLA1CYP46A1NPC1L1NPC1PLA2G2A
SCHEMBL30475052 0.89 CYP46A1 (0.54) POLA1CYP46A1NPC1L1NPC1PLA2G2A
SCHEMBL8608988 0.83 POLA1 (0.75) POLA1CYP46A1NPC1L1NPC1PLA2G2A
SCHEMBL28273010 0.83 POLA1 (0.75) POLA1CYP46A1NPC1L1NPC1PLA2G2A
SCHEMBL11497304 0.83 POLA1 (0.75) POLA1CYP46A1NPC1L1NPC1PLA2G2A
SCHEMBL8839992 0.83 POLA1 (0.75) POLA1CYP46A1NPC1L1NPC1PLA2G2A
SCHEMBL28088865 0.83 POLA1 (0.75) POLA1CYP46A1NPC1L1NPC1PLA2G2A
SCHEMBL29356325 0.83 POLA1 (0.73) POLA1CYP46A1NPC1L1NPC1PLA2G2A
SCHEMBL28404863 0.83 POLA1 (0.73) POLA1CYP46A1NPC1L1NPC1PLA2G2A
SCHEMBL8425524 0.83 POLA1 (0.73) POLA1CYP46A1NPC1L1NPC1PLA2G2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8454991-B2 Method and device for photodynamic therapy QUEST PHARMATECH INC. 2013-06-04 — — US claimed
US-20090204057-A1 METHOD AND DEVICE FOR PHOTODYNAMIC THERAPY QUEST PHARMATECH INC. (CA) 2009-08-13 — — US claimed
WO-2008011707-A1 METHOD AND DEVICE FOR PHOTODYNAMIC THERAPY QUEST PHARMATECH INC. (CA) 2008-01-31 — — WO claimed
EP-1039834-B1 OPTOACOUSTIC CONTRAST AGENTS AND METHODS FOR THEIR USE IMARX PHARMACEUTICAL CORP (US) 2005-09-28 — — EP claimed
EP-1039834-A4 OPTOACOUSTIC CONTRAST AGENTS AND METHODS FOR THEIR USE IMARX PHARMACEUTICAL CORP (US) 2001-12-05 — — EP claimed
EP-1039834-A1 OPTOACOUSTIC CONTRAST AGENTS AND METHODS FOR THEIR USE IMARX PHARMACEUTICAL CORP. (US) 2000-10-04 — — EP claimed
US-6123923-A ADMINISTERING A PATIENT A CONTRAST AGENT CONTAINING A STABILIZER, A PHOTOACTIVE AGENT, A GASEOUS PRECURSOR SUCH AS PERFLUORINATED COMPOUND OR GAS OR BOTH, AND SCANNING THE PATIENT USING ULTRASOUND IMAGING AND OPTICAL IMAGING IMARX PHARMACEUTICAL CORP. (US) 2000-09-26 — — US claimed
WO-1999030620-A1 OPTOACOUSTIC CONTRAST AGENTS AND METHODS FOR THEIR USE IMARX PHARMACEUTICAL CORP. (US) 1999-06-24 — — WO claimed
US-8454991-B2 Method and device for photodynamic therapy QUEST PHARMATECH INC. 2013-06-04 — — US disclosed
US-20090204057-A1 METHOD AND DEVICE FOR PHOTODYNAMIC THERAPY QUEST PHARMATECH INC. (CA) 2009-08-13 — — US disclosed
EP-1651276-A4 EMULSION PARTICLES FOR IMAGING AND THERAPY AND METHODS OF USE THEREOF BARNES JEWISH HOSPITAL (US) 2009-05-06 — — EP disclosed
EP-2019667-A2 DETECTION AND IMAGING OF TARGET TISSUE Barnes-Jewish Hospital (US) 2009-02-04 — — EP disclosed
EP-1684724-A4 ENHANCED DRUG DELIVERY BARNES JEWISH HOSPITAL (US) 2008-04-02 — — EP disclosed
WO-2008011707-A1 METHOD AND DEVICE FOR PHOTODYNAMIC THERAPY QUEST PHARMATECH INC. (CA) 2008-01-31 — — WO disclosed
WO-2005014051-A1 EMULSION PARTICLES FOR IMAGING AND THERAPY AND METHODS OF USE THEREOF BARNES-JEWISH HOSPITAL (US) 2005-02-17 — — WO disclosed
US-20020102216-A1 Enhanced ultrasound detection with temperature-dependent contrast agents KEREOS, INC. 2002-08-01 — — US disclosed
EP-1039834-A4 OPTOACOUSTIC CONTRAST AGENTS AND METHODS FOR THEIR USE IMARX PHARMACEUTICAL CORP (US) 2001-12-05 — — EP disclosed
EP-1039834-A1 OPTOACOUSTIC CONTRAST AGENTS AND METHODS FOR THEIR USE IMARX PHARMACEUTICAL CORP. (US) 2000-10-04 — — EP disclosed
US-6123923-A ADMINISTERING A PATIENT A CONTRAST AGENT CONTAINING A STABILIZER, A PHOTOACTIVE AGENT, A GASEOUS PRECURSOR SUCH AS PERFLUORINATED COMPOUND OR GAS OR BOTH, AND SCANNING THE PATIENT USING ULTRASOUND IMAGING AND OPTICAL IMAGING IMARX PHARMACEUTICAL CORP. (US) 2000-09-26 — — US disclosed
WO-1999030620-A1 OPTOACOUSTIC CONTRAST AGENTS AND METHODS FOR THEIR USE IMARX PHARMACEUTICAL CORP. (US) 1999-06-24 — — WO disclosed
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