SCHEMBL649476

SCHEMBL649476

O=C1OC2(c3ccc(O)cc3Oc3cc(O)ccc32)c2ccc3ccccc3c21

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 3/20 0.67
TYMS P04818 2/20 0.67
FTO Q9C0B1 8/20 0.61
MAPT P10636 3/20 0.61
HPGD P15428 2/20 0.61
MEN1 O00255 2/20 0.61
HTT P42858 2/20 0.61
KMT2A Q03164 2/20 0.61
CYP2C19 P33261 1/20 0.61
RECQL P46063 1/20 0.61
BLM P54132 1/20 0.61
SMAD3 P84022 1/20 0.61
PRMT1 Q99873 1/20 0.61
ACE2 Q9BYF1 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
ALOX12 P18054 2/20 0.58
ALDH1A1 P00352 2/20 0.58
CYP2C9 P11712 1/20 0.58
ALOX15 P16050 1/20 0.58
BRCA1 P38398 1/20 0.58

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
SCHEMBL27956847 0.87 FTO (0.65) DHFRTYMSFTOMAPTHPGD
SCHEMBL3419234 0.86 DHFR (0.52) DHFRTYMSFTOMAPTHPGD
SCHEMBL4635984 0.85 DHFR (0.59) DHFRTYMSFTOMAPTHPGD
SCHEMBL3607641 0.81 DHFR (1.00) DHFRTYMSMAPTHPGDMEN1
SCHEMBL214054 0.80 HPGD (0.67) DHFRTYMSFTOMAPTHPGD
SCHEMBL4056456 0.80 FTO (0.62) DHFRTYMSFTOMAPTHPGD
SCHEMBL6662140 0.80 FTO (0.74) DHFRTYMSFTOMAPTHPGD
SCHEMBL3189664 0.80 FTO (0.66) DHFRTYMSFTOMAPTHPGD
SCHEMBL139173 0.80 FTO (0.65) DHFRTYMSFTOMAPTHPGD
SCHEMBL31063767 0.79 FTO (0.73) DHFRTYMSFTOMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5773236-A FLUORESCENT DYES FOR DETECTION OF ENZYMES FOR METABOLISM IN CELLS MOLECULE PROBES, INC. (US) 1998-06-30 US claimed
US-5516864-A Fluorescent ion-selective diaryldiaza crown ether conjugates MOLECULAR PROBES, INC. (US) 1996-05-14 US claimed
US-5405975-A Detectors for alkali metal ions in aqueous solution MOLECULAR PROBES, INC. (US) 1995-04-11 US claimed
CN-117897454-A Dibenzoxanthene quencher, use and preparation method 生命技术公司 2024-04-16 CN disclosed
CN-108463560-B Optical-based nanopore analysis with reduced background 昆塔波尔公司 2022-09-20 CN disclosed
EP-3242690-B1 NEAR-INFRARED FLUORESCENT SURGICAL DYE MARKERS DE HAAS ANTHONY H (US) 2020-09-16 EP disclosed
US-10383957-B2 Near-infrared fluorescent surgical dye markers de Haas, Anthony H. (US) 2019-08-20 US disclosed
CN-109477813-A Optical-based nanopore sequencing 昆塔波尔公司 2019-03-15 CN disclosed
CN-109415765-A With the hybrid optical signal in the polymer analysis of nano-pore 昆塔波尔公司 2019-03-01 CN disclosed
EP-3242690-A1 NEAR-INFRARED FLUORESCENT SURGICAL DYE MARKERS De Haas, Anthony H. (US) 2017-11-15 EP disclosed
WO-2016111915-A1 NEAR-INFRARED FLUORESCENT SURGICAL DYE MARKERS DE HAAS ANTHONY H (US) 2016-07-14 WO disclosed
US-6013802-A AS FLUROESCENT INDICATORS FOR DETECTION AND QUANTIFICATION OF METAL IONS MOLECULAR PROBES, INC. (US) 2000-01-11 US disclosed
WO-1998052609-A1 SONODYNAMIC THERAPY USING AN ULTRASOUND SENSITIZER COMPOUND NYCOMED IMAGING AS (NO) 1998-11-26 WO disclosed
WO-1998048845-A1 METHOD OF DEMARCATING TISSUE NYCOMED IMAGING AS (NO) 1998-11-05 WO disclosed
US-5773236-A FLUORESCENT DYES FOR DETECTION OF ENZYMES FOR METABOLISM IN CELLS MOLECULE PROBES, INC. (US) 1998-06-30 US disclosed
US-5773227-A CHELATE COMPOUNDS, FLUORESCENT INDICATOR AND TARGET PEPTIDES MOLECULAR PROBES, INC. (US) 1998-06-30 US disclosed
US-5648270-A FLUORESCENT INDICATORS USING METAL-PYRIDINE COMPLEXES MOLECULAR PROBES, INC. (US) 1997-07-15 US disclosed
US-5635608-A CONTAINS PHOTOREMOVABLE ALPHA-CARBOXY-SUBSTITUTED ORTHO-NITROBENZYL GROUP THAT CHANGES THE FLUORESCENCE AND BIOLOGICAL PROPERTIES OF THE COMPOUND MOLECULAR PROBES, INC. (US) 1997-06-03 US disclosed
US-5516864-A Fluorescent ion-selective diaryldiaza crown ether conjugates MOLECULAR PROBES, INC. (US) 1996-05-14 US disclosed
US-5405975-A Detectors for alkali metal ions in aqueous solution MOLECULAR PROBES, INC. (US) 1995-04-11 US disclosed