SCHEMBL4953807

SCHEMBL4953807

[CH2]CCCCCCCCC1=CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
ALOX15 P16050 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.39
USP2 O75604 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PKM P14618 1/20 0.38
TAAR1 Q96RJ0 1/20 0.37
RAB9A P51151 3/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPC1 O15118 2/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALOX12 P18054 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL4325783 1.00 ALDH1A1 (0.42) ALDH1A1ALOX15SMN1; SMN2USP2NPSR1
SCHEMBL791252 0.98 ALDH1A1 (0.43) ALDH1A1ALOX15SMN1; SMN2USP2NPSR1
SCHEMBL4337065 0.96 SMN1; SMN2 (0.42) ALDH1A1ALOX15SMN1; SMN2USP2NPSR1
SCHEMBL4337073 0.96 SMN1; SMN2 (0.42) ALDH1A1ALOX15SMN1; SMN2USP2NPSR1
SCHEMBL4954390 0.94 ALDH1A1 (0.36) ALDH1A1ALOX15SMN1; SMN2USP2NPSR1
SCHEMBL9202745 0.94 ALDH1A1 (0.36) ALDH1A1ALOX15SMN1; SMN2USP2NPSR1
SCHEMBL4953613 0.94 ALDH1A1 (0.36) ALDH1A1ALOX15SMN1; SMN2USP2NPSR1
SCHEMBL6322740 0.94 ALDH1A1 (0.36) ALDH1A1ALOX15SMN1; SMN2USP2NPSR1
SCHEMBL9214644 0.94 ALDH1A1 (0.36) ALDH1A1ALOX15SMN1; SMN2USP2NPSR1
SCHEMBL4333124 0.92 ALDH1A1 (0.44) ALDH1A1ALOX15SMN1; SMN2USP2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1973919-A2 ONE POT SYNTHESIS OF TETRAZOLE DERIVATIVES OF SIROLIMUS Abbott Laboratories (US) 2008-10-01 EP disclosed
WO-2007094886-A2 ONE POT SYNTHESIS OF TETRAZOLE DERIVATIVES OF SIROLIMUS ABBOTT LABORATORIES (US) 2007-08-23 WO disclosed
EP-1326603-A1 COMPOSITION COMPRISING A CATALYST FOR THE DISMUTATION OF SUPEROXIDE AND USE OF THE COMPOSITION FOR PREVENTING AND TREATING HYPOTENSION Pharmacia Corporation (US) 2003-07-16 EP disclosed
WO-2003024434-A2 USE OF A SUPEROXIDE DISMUTASE MIMETIC CATALYST IN THE MANUFACTURE OF A MEDICAMENT FOR PREVENTING AND TREATING HIV-MEDIATED CENTRAL NERVOUS SYSTEM DAMAGE METAPHORE PHARMACEUTICALS, INC. (US) 2003-03-27 WO disclosed
WO-2001019823-A9 SUBSTITUTED PYRIDINO PENTAAZAMACROCYLE COMPLEXES HAVING SUPEROXIDE DISMUTASE ACTIVITY MONSANTO CO (US) 2002-09-26 WO disclosed
WO-2002028390-A1 COMPOSITION COMPRISING A CATALYST FOR THE DISMUTATION OF SUPEROXIDE AND USE OF THE COMPOSITION FOR PREVENTING AND TREATING HYPOTENSION PHARMACIA CORPORATION (US) 2002-04-11 WO disclosed
EP-0891338-A1 BIOCONJUGATES OF MANGANESE OR IRON COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS EFFECTIVE AS CATALYSTS FOR DISMUTATING SUPEROXIDE MONSANTO COMPANY (US) 1999-01-20 EP disclosed
EP-0888115-A1 IRON COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS EFFECTIVE AS CATALYSTS FOR DISMUTATING SUPEROXIDE MONSANTO COMPANY (US) 1999-01-07 EP disclosed
EP-0846003-A1 METHODS OF DIAGNOSTIC IMAGE ANALYSIS USING BIOCONJUGATES OF METAL COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS MONSANTO COMPANY (US) 1998-06-10 EP disclosed
EP-0844886-A2 BIOCONJUGATES OF MANGANESE COMPLEXES AND THEIR APPLICATION AS CATALYSTS MONSANTO COMPANY (US) 1998-06-03 EP disclosed
WO-1997033588-A9 IRON COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS EFFECTIVE AS CATALYSTS FOR DISMUTATING SUPEROXIDE 1997-11-06 WO disclosed
WO-1997033588-A1 IRON COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS EFFECTIVE AS CATALYSTS FOR DISMUTATING SUPEROXIDE MONSANTO COMPANY (US) 1997-09-18 WO disclosed
WO-1997033877-A1 BIOCONJUGATES OF MANGANESE OR IRON COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS EFFECTIVE AS CATALYSTS FOR DISMUTATING SUPEROXIDE MONSANTO COMPANY (US) 1997-09-18 WO disclosed
WO-1997006830-A1 METHODS OF DIAGNOSTIC IMAGE ANALYSIS USING BIOCONJUGATES OF METAL COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS MONSANTO COMPANY (US) 1997-02-27 WO disclosed
WO-1997006831-A1 METHODS OF DIAGNOSTIC IMAGE ANALYSIS USING METAL COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS MONSANTO COMPANY (US) 1997-02-27 WO disclosed
EP-0756495-A1 DIAGNOSTIC IMAGE ANALYSIS WITH METAL COMPLEXES MONSANTO COMPANY (US) 1997-02-05 EP disclosed
EP-0679155-A1 MANGANESE COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS EFFECTIVE AS CATALYSTS FOR DISMUTATING SUPEROXIDE. MONSANTO CO (US) 1995-11-02 EP disclosed
EP-0421441-B1 Pantothenic acid derivatives FUJIREBIO KK (JP) 1995-01-25 EP disclosed
US-5120738-A Cardiovascular disorders FUJIREBIO INC. (JP) 1992-06-09 US disclosed
EP-0421441-A2 Pantothenic acid derivatives FUJIREBIO INC. (JP) 1991-04-10 EP disclosed