SCHEMBL8935880

SCHEMBL8935880

[Li]c1ccc(C=CCOCC=Cc2ccc([Li])cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.42
SIGMAR1 Q99720 6/20 0.34
HTR2A P28223 5/20 0.34
HTR2C P28335 5/20 0.34
HTR2B P41595 5/20 0.34
DRD2 P14416 2/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
RECQL P46063 1/20 0.32
ABCB1 P08183 1/20 0.32
ALOX5 P09917 1/20 0.32

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
SCHEMBL8407916 0.77 APP (0.50) IDO1
SCHEMBL7627267 0.77 IDO1 (0.42) IDO1ALDH1A1CYP3A4
SCHEMBL7514298 0.76 IDO1 (0.68) IDO1SIGMAR1HTR2AHTR2CHTR2B
SCHEMBL17710972 0.74 KDM4E (0.57) ALDH1A1CYP3A4ABCB1ALOX5
SCHEMBL15514435 0.72 APP (0.55)
SCHEMBL7785446 0.71 ALDH1A1 (0.46) IDO1SIGMAR1HTR2AHTR2CHTR2B
SCHEMBL15515043 0.70 IDO1 (0.48) IDO1SIGMAR1HTR2AHTR2CHTR2B
SCHEMBL9511296 0.70 IDO1 (0.36) IDO1ALDH1A1CYP3A4ABCB1ALOX5
SCHEMBL27677140 0.69 CYP4F2 (0.43) IDO1SIGMAR1HTR2AHTR2CHTR2B
SCHEMBL1158123 0.68 IDO1 (0.57) IDO1SIGMAR1HTR2AHTR2CHTR2B

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5589586-A Nucleosides attached to a solid support through a 3'-silyl linkage and their use in oligonucleotide synthesis PHARMACIA LKB BIOTECHNOLOGY AB (SE) 1996-12-31 US disclosed
EP-0514513-B1 METHOD AND MEANS FOR OLIGONUCLEOTIDE SYNTHESIS PHARMACIA BIOTECH AB (SE) 1996-01-31 EP disclosed
EP-0514513-A1 METHOD AND MEANS FOR OLIGONUCLEOTIDE SYNTHESIS. PHARMACIA LKB BIOTECH (SE) 1992-11-25 EP disclosed
WO-1992009615-A1 METHOD AND MEANS FOR OLIGONUCLEOTIDE SYNTHESIS PHARMACIA LKB BIOTECHNOLOGY AB (SE) 1992-06-11 WO disclosed