SCHEMBL5160967

SCHEMBL5160967

C=c1c2cccc3cccc(c32)c2c3ccccc3c12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.54
HSD17B10 Q99714 9/20 0.54
CYP1A2 P05177 7/20 0.54
HPGD P15428 7/20 0.54
THRB P10828 1/20 0.54
MAOA P21397 2/20 0.43
ERBB2 P04626 1/20 0.43
FYN P06241 1/20 0.43
ACHE P22303 1/20 0.43
AHR P35869 1/20 0.43
TSHR P16473 7/20 0.39
CYP3A4 P08684 4/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1B1 Q16678 1/20 0.39
L3MBTL1 Q9Y468 4/20 0.39
MAPK1 P28482 3/20 0.39
CASP1 P29466 2/20 0.39
HIF1A Q16665 2/20 0.39
ATM Q13315 1/20 0.39
CYP2A6 P11509 3/20 0.38

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
SCHEMBL4501676 0.84 ALDH1A1 (0.63) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4856708 0.82 ALDH1A1 (0.62) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL347568 0.82 ALDH1A1 (0.60) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL5477252 0.82 ALDH1A1 (0.60) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL29105767 0.79 ALDH1A1 (0.63) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL29354688 0.79 ALDH1A1 (0.63) ALDH1A1HSD17B10CYP1A2HPGDTHRB
Triphenylene SCHEMBL28972585 0.79 ALDH1A1 (0.82) ALDH1A1HSD17B10CYP1A2HPGDTHRB
Naphthalene SCHEMBL87628 0.79 ALDH1A1 (0.72) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL29369890 0.79 ALDH1A1 (0.63) ALDH1A1HSD17B10CYP1A2HPGDTHRB
Triphenylene SCHEMBL5501206 0.79 ALDH1A1 (0.82) ALDH1A1HSD17B10CYP1A2HPGDTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6221303-B1 NOVEL POLYOXYALKYLENE-UNIT-CONTAINING BLOCK COPOLYMERS HAVING A NUMBER OF CROSSLINKABLE SIDE GROUPS, CONTACT LENSES, NOVARTIS AG (CH) 2001-04-24 US claimed
EP-0961941-A1 OPHTHALMIC MOULDINGS Novartis AG (CH) 1999-12-08 EP claimed
WO-1998037441-A1 OPHTHALMIC MOULDINGS NOVARTIS AG (CH) 1998-08-27 WO claimed
EP-0146326-B1 SULFOPOLYESTER-CONTAINING PHOTOPOLYMER SYSTEMS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-03-13 EP claimed
EP-0146326-A2 Sulfopolyester-containing photopolymer systems MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-06-26 EP claimed
US-7250245-B2 Switchable polymer printing plates with carbon bearing ionic and steric stabilizing groups EASTMAN KODAK COMPANY (US) 2007-07-31 US disclosed
US-7077516-B2 Inkjet printing method EASTMAN KODAK COMPANY (US) 2006-07-18 US disclosed
US-20050260509-A1 Switchable polymer printing plates with carbon bearing ionic and steric stabilizing groups KODAK REALTY INC. 2005-11-24 US disclosed
US-6908186-B2 Inkjet ink composition and an ink/receiver combination EASTMAN KODAK COMPANY (US) 2005-06-21 US disclosed
US-6846608-B2 Coating with a photothermal converter and a polymer comprising thiosulfate groups and applying a water soluble topcoat KODAK POLYCHROME GRAPHICS LLC (US) 2005-01-25 US disclosed
WO-2004094542-A1 INKJET PRINTING METHOD EASTMAN KODAK COMPANY (US) 2004-11-04 WO disclosed
US-20040189762-A1 INKJET PRINTING METHOD EASTMAN KODAK COMPANY 2004-09-30 US disclosed
US-6399268-B1 Processless direct write imaging member containing polymer grafted carbon and methods of imaging and printing KODAK POLYCHROME GRAPHICS LLC 2002-06-04 US disclosed
WO-2002000442-A1 IMAGING MEMBER CONTAINING HEAT-SENSITIVE THIOSULPHATE POLYMER ANDMETHODS OF USE KODAK POLYCHROME GRAPHICS CO. LTD. (US) 2002-01-03 WO disclosed
EP-1093417-A1 PROCESSLESS DIRECT WRITE IMAGING MEMBER CONTAINING POLYMER GRAFTED CARBON AND METHODS OF IMAGING AND PRINTING Kodak Polychrome Graphics Company Ltd. (US) 2001-04-25 EP disclosed
WO-2000063025-A1 PROCESSLESS DIRECT WRITE IMAGING MEMBER CONTAINING POLYMER GRAFTED CARBON AND METHODS OF IMAGING AND PRINTING KODAK POLYCHROME GRAPHICS COMPANY LTD. (US) 2000-10-26 WO disclosed
EP-0961941-A1 OPHTHALMIC MOULDINGS Novartis AG (CH) 1999-12-08 EP disclosed
WO-1998037441-A1 OPHTHALMIC MOULDINGS NOVARTIS AG (CH) 1998-08-27 WO disclosed
EP-0146326-B1 SULFOPOLYESTER-CONTAINING PHOTOPOLYMER SYSTEMS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-03-13 EP disclosed
EP-0146326-A2 Sulfopolyester-containing photopolymer systems MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-06-26 EP disclosed