Sugi Predict

Sugi Predict / Compounds / SCHEMBL5311667

SCHEMBL5311667

SCHEMBL5311667

O=[N+]([O-])c1cccc2cccc(F)c12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.52
▸ TDP1 Q9NUW8 4/20 0.48
▸ GPR35 Q9HC97 2/20 0.47
▸ PDE10A Q9Y233 1/20 0.46
▸ MAPT P10636 3/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ GAA P10253 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ TYMS P04818 1/20 0.44
▸ TSHR P16473 3/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ NOS1 P29475 2/20 0.43
▸ NOS2 P35228 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ THRB P10828 1/20 0.43

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
SCHEMBL29626558 0.85 ALDH1A1 (0.61) ALDH1A1TDP1GPR35PDE10AMAPT
SCHEMBL187697 0.85 ALDH1A1 (0.61) ALDH1A1TDP1GPR35PDE10AMAPT
SCHEMBL999378 0.80 TDP1 (0.45) ALDH1A1TDP1GPR35PDE10AMAPT
SCHEMBL2005731 0.79 ALDH1A1 (0.43) ALDH1A1TDP1GPR35PDE10AMAPT
SCHEMBL2924859 0.78 TDP1 (0.50) ALDH1A1TDP1GPR35PDE10AMAPT
SCHEMBL29355089 0.77 TDP1 (0.54) ALDH1A1TDP1GPR35PDE10AMAPT
SCHEMBL307855 0.77 TDP1 (0.54) ALDH1A1TDP1GPR35PDE10AMAPT
Pyrene SCHEMBL27684019 0.77 ALDH1A1 (0.63) ALDH1A1TDP1GPR35PDE10AMAPT
SCHEMBL29482305 0.76 TDP1 (0.56) ALDH1A1TDP1GPR35MAPTMEN1
SCHEMBL12444133 0.76 TDP1 (0.56) ALDH1A1TDP1GPR35MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100410256-C Optical diamine monomer containing di-dehydrated-hexitol unit and process for preparing same UNIV TSINGHUA (CN) 2008-08-13 — — CN claimed
CN-1320031-C Polyamide containing isosorbide unit and process for preparing same UNIV TSINGHUA (CN) 2007-06-06 — — CN claimed
CN-1702095-A Polyamide containing isosorbide unit and process for preparing same UNIV TSINGHUA (CN) 2005-11-30 — — CN claimed
CN-1702097-A Optical polyimide containing isosorbide unit and process for preparing same UNIV TSINGHUA (CN) 2005-11-30 — — CN claimed
CN-1702071-A Optical diamine monomer containing di-dehydrated-hexitol unit and process for preparing same UNIV TSINGHUA (CN) 2005-11-30 — — CN claimed
CN-115232010-A Method for preparing 1-fluoro-4-nitronaphthalene through microchannel reaction 中国科学技术大学先进技术研究院 2022-10-25 — — CN disclosed
CN-100410256-C Optical diamine monomer containing di-dehydrated-hexitol unit and process for preparing same UNIV TSINGHUA (CN) 2008-08-13 — — CN disclosed
CN-1320031-C Polyamide containing isosorbide unit and process for preparing same UNIV TSINGHUA (CN) 2007-06-06 — — CN disclosed
WO-2007049124-A1 METHOD OF MAKING 8-FLUORO-NAPHTHALEN-1-YLAMINE AND RELATED COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-05-03 — — WO disclosed
WO-2007049124-A1 METHOD OF MAKING 8-FLUORO-NAPHTHALEN-1-YLAMINE AND RELATED COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-05-03 — — WO disclosed
CN-1702095-A Polyamide containing isosorbide unit and process for preparing same UNIV TSINGHUA (CN) 2005-11-30 — — CN disclosed
CN-1702097-A Optical polyimide containing isosorbide unit and process for preparing same UNIV TSINGHUA (CN) 2005-11-30 — — CN disclosed
CN-1702071-A Optical diamine monomer containing di-dehydrated-hexitol unit and process for preparing same UNIV TSINGHUA (CN) 2005-11-30 — — CN disclosed