Anisole

Anisole

SCHEMBL3801846

CCOc1cc([N+]#N)c(OCC)cc1S.COc1ccccc1.[Cl-]

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Anisole. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 5/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
LTA4H P09960 2/20 0.35
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
MAOB P27338 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
POLB P06746 3/20 0.33
AR P10275 1/20 0.33
CALM1 P0DP23 1/20 0.33
CASP6 P55212 1/20 0.33

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
Anisole SCHEMBL5679467 0.89 MAPT (0.39) L3MBTL1MAPTMEN1KMT2AALDH1A1
Toluene SCHEMBL8493100 0.82 L3MBTL1 (0.35) L3MBTL1MAPTALDH1A1CYP1A2CYP2C19
Hydrochloric Acid SCHEMBL3798277 0.77 LTA4H (0.46) L3MBTL1LTA4HALDH1A1POLBAR
Anisole SCHEMBL11744726 0.75 LTA4H (0.44) CA4L3MBTL1MAPTKMT2ALTA4H
Hydrochloric Acid SCHEMBL3801844 0.72 MEN1 (0.36) L3MBTL1MAPTMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL9165477 0.71 KMT2A (0.43) L3MBTL1MAPTMEN1KMT2AALDH1A1
Toluene SCHEMBL7029684 0.71 ACHE (0.34) CA4MEN1KMT2AALDH1A1CYP1A2
SCHEMBL11068289 0.69 POLB (0.35) L3MBTL1MAPTLTA4HALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL11120185 0.69 PTPN1 (0.43) L3MBTL1MAPTKMT2AALDH1A1POLB
Sulfuric Acid SCHEMBL5676614 0.69 LTA4H (0.41) L3MBTL1MAPTMEN1KMT2ALTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8703092-B2 Type separation of single-walled carbon nanotubes via two-phase liquid extraction UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2014-04-22 US disclosed
US-20100166637-A1 Type Separation of Single-Walled Carbon Nanotubes via Two-Phase Liquid Extraction UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2010-07-01 US disclosed
WO-2008057070-A2 TYPE SEPARATION OF SINGLE-WALLED CARBON NANOTUBES VIA PHASE TRANSFER UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2008-05-15 WO disclosed
US-6861196-B2 Photosensitive compositions having mixtures of alkoxy and non-alkoxy diazonium salt containing compounds KODAK POLYCHROME GRAPHICS LLC (US) 2005-03-01 US disclosed
US-6821583-B2 SUBSTRATE WITH A CROSSLINKED LAYER DISPOSED ON IT HAVING AN IMAGEABLE INK-RECEPTIVE LAYER THAT IS ABLATION FREE KODAK POLYCHROME GRAPHICS LLC 2004-11-23 US disclosed
US-6806020-B2 PRINTING PLATE PATTERNS; MIXTURE OF ACID, ACID GENERATOR AND ACID CURABLE COMPOUND KODAK POLYCHROME GRAPHICS LLC 2004-10-19 US disclosed
US-20040063022-A1 Photosensitive compositions having mixtures of alkoxy and non-alkoxy diazonium salt containing compounds KODAK POLYCHROME GRAPHICS, LLC. 2004-04-01 US disclosed
US-20040009363-A1 Substrate with a crosslinked layer disposed on it having an imageable ink-receptive layer that is ablation free KODAK POLYCHROME GRAPHICS, L.L.C. (US) 2004-01-15 US disclosed
US-6638679-B2 Photosensitive compositions having mixtures of alkoxy and non-alkoxy diazonium salt containing compounds KODAK POLYCHROME GRAPHICS, LLC 2003-10-28 US disclosed
US-20030082474-A1 Printing plate patterns; mixture of acid, acid generator and acid curable compound KODAK POLYCHROME GRAPHICS, L.L.C 2003-05-01 US disclosed
WO-2003007076-A2 PHOTOSENSITIVE COMPOSITIONS HAVING MIXTURES OF ALKOXY AND NON-ALKOXY DIAZONIUM SALT CONTAINING COMPOUNDS KODAC POLYCHROME GRAPHICS, L.L.C. (US) 2003-01-23 WO disclosed
US-20030013035-A1 Photosensitive compositions having mixtures of alkoxy and non-alkoxy diazonium salt containing compounds KODAK POLYCHROME GRAPHICS, L.L.C. 2003-01-16 US disclosed
EP-0428362-B1 Photosensitive resin and element made therefrom HOECHST CELANESE CORP (US) 1995-04-19 EP disclosed
US-5200291-A Photosensitive diazonium resin, element made therefrom, method of preparing the resin and method for producing negative lithographic image utilizing the resin HOECHST CELANESE CORPORATION (US) 1993-04-06 US disclosed
EP-0428362-A1 Photosensitive resin and element made therefrom HOECHST CELANESE CORPORATION (US) 1991-05-22 EP disclosed
US-4914000-A Three dimensional reproduction material diazonium condensates and use in light sensitive HOECHST CELANESE CORPORATION (US) 1990-04-03 US disclosed
EP-0326714-A2 Three dimensional light-sensitive diazonium condensates HOECHST CELANESE CORPORATION (US) 1989-08-09 EP disclosed
US-4436804-A Light-sensitive polymeric diazonium condensates and reproduction compositions and materials therewith AMERICAN HOECHST CORPORATION (US) 1984-03-13 US disclosed