SCHEMBL8711737

SCHEMBL8711737

OP(O)OSCc1ccc(Cl)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.56
CYP3A4 P08684 2/20 0.56
CYP2C19 P33261 2/20 0.56
CYP2C9 P11712 1/20 0.56
MAPK1 P28482 1/20 0.56
IDO1 P14902 12/20 0.50
HTT P42858 3/20 0.50
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
EPHX1 P07099 2/20 0.42
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
ALOX12 P18054 1/20 0.40

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
SCHEMBL8716375 0.74 IDO1 (0.46) CYP1A2CYP2C19CYP2C9MAPK1IDO1
SCHEMBL4863737 0.73 CYP1A2 (1.00) CYP1A2CYP3A4CYP2C19CYP2C9MAPK1
SCHEMBL9715921 0.73 IDO1 (0.58) CYP1A2CYP3A4CYP2C19CYP2C9MAPK1
SCHEMBL29697198 0.70 CYP1A2 (0.53) CYP1A2CYP3A4CYP2C19CYP2C9MAPK1
SCHEMBL6011647 0.70 CYP1A2 (0.69) CYP1A2CYP3A4CYP2C19CYP2C9MAPK1
SCHEMBL14959149 0.70 IDO1 (0.54) CYP1A2CYP3A4CYP2C19CYP2C9MAPK1
SCHEMBL11353946 0.70 CYP1A2 (0.69) CYP1A2CYP3A4CYP2C19CYP2C9MAPK1
SCHEMBL11443342 0.69 IDO1 (0.64) CYP1A2CYP3A4CYP2C19CYP2C9MAPK1
SCHEMBL11228484 0.68 CYP1A2 (0.80) CYP1A2CYP3A4CYP2C19CYP2C9MAPK1
SCHEMBL10724739 0.68 CYP1A2 (0.71) CYP1A2CYP3A4CYP2C19CYP2C9MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5750666-A FOR SYNTHESIZING NEW MONONUCLEOTIDES AND POLYNUCLEOTIDES HAVING PHOSPHOROTHIOATE AND PHOSPHORODITHIOATE INTERNUCLEOTIDE LINKAGES COMPETITVE TECHNOLOGIES, INC. (US) 1998-05-12 US disclosed
US-5684148-A NUCLEOSIDES AND POLYNUCLEOTIDES AS FLUORESCENT AGENTS FOR MEDICAL DIAGNOSIS COMPETITIVE TECHNOLOGIES, INC. (US) 1997-11-04 US disclosed
US-5602244-A DINUCLEOSIDE PRECURSORS IN OLIGONUCLEOTIDE SYNTHESIS; USEFUL AS ANTISENSE INHIBITORS OF TRANSLATION COMPETITIVE TECHNOLOGIES, INC. (US) 1997-02-11 US disclosed
US-5218103-A Nucleoside thiophosphoramidites UNIVERSITY PATENTS, INC. (US) 1993-06-08 US disclosed
WO-1991004983-A1 NUCLEOSIDE AND POLYNUCLEOTIDE THIOPHOSPHORAMIDITE AND PHOSPHORODITHIOATE COMPOUNDS AND PROCESSES UNIVERSITY PATENTS, INC. (US) 1991-04-18 WO disclosed