SCHEMBL4847673

SCHEMBL4847673

c1ccc2c(c1)ccc1cc3cc4ccc5ccccc5c4cc3cc12

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.89
HSD17B10 Q99714 3/20 0.89
CYP1B1 Q16678 2/20 0.89
HIF1A Q16665 1/20 0.89
CYP2A6 P11509 1/20 0.67
TSHR P16473 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
CYP1A2 P05177 3/20 0.61
HPGD P15428 2/20 0.61
HPRT1 P00492 3/20 0.60
ERBB2 P04626 1/20 0.54
FYN P06241 1/20 0.54
MAOA P21397 1/20 0.54
ACHE P22303 1/20 0.54
AHR P35869 1/20 0.54
PAX8 Q06710 1/20 0.48
TRPM4 Q8TD43 1/20 0.48
CYP1A1 P04798 1/20 0.47
MAPT P10636 1/20 0.47
HTR2A P28223 1/20 0.46

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
SCHEMBL4851898 1.00 ALDH1A1 (0.89) ALDH1A1HSD17B10CYP1B1HIF1ACYP2A6
SCHEMBL30484226 1.00 ALDH1A1 (0.89) ALDH1A1HSD17B10CYP1B1HIF1ACYP2A6
SCHEMBL4852173 1.00 ALDH1A1 (0.89) ALDH1A1HSD17B10CYP1B1HIF1ACYP2A6
SCHEMBL988961 1.00 ALDH1A1 (0.89) ALDH1A1HSD17B10CYP1B1HIF1ACYP2A6
SCHEMBL4848822 0.97 ALDH1A1 (0.84) ALDH1A1HSD17B10CYP1B1HIF1ACYP2A6
SCHEMBL1799999 0.97 ALDH1A1 (0.84) ALDH1A1HSD17B10CYP1B1HIF1ACYP2A6
SCHEMBL4854620 0.97 ALDH1A1 (0.84) ALDH1A1HSD17B10CYP1B1HIF1ACYP2A6
SCHEMBL1230609 0.97 ALDH1A1 (0.84) ALDH1A1HSD17B10CYP1B1HIF1ACYP2A6
SCHEMBL31326805 0.97 ALDH1A1 (0.84) ALDH1A1HSD17B10CYP1B1HIF1ACYP2A6
SCHEMBL30839396 0.97 ALDH1A1 (0.84) ALDH1A1HSD17B10CYP1B1HIF1ACYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7470290-B2 Hydroscopic polymer gels for easier cleaning THE CLOROX COMPANY (US) 2008-12-30 US disclosed
US-7183010-B2 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK CORPORATION (US) 2007-02-27 US disclosed
US-20050245428-A1 Hydroscopic polymer gels for easier cleaning RODRIGUES KLIN A 2005-11-03 US disclosed
EP-1481428-A1 ORGANIC THIN FILM TRANSISTOR WITH MODIFIED SURFACE OF GATE-DIELECTRIC 3M Innovative Properties Company (US) 2004-12-01 EP disclosed
US-6768132-B2 MULTILAYER INTEGRATED CIRCUIT; BARRIER DIELECTRIC AND SEMICONDUCTOR 3M INNOVATIVE PROPERTIES COMPANY 2004-07-27 US disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed
US-20030175551-A1 Surface modified organic thin film transistors 3M INNOVATIVE PROPERTIES COMPANY 2003-09-18 US disclosed
WO-2003077327-A1 ORGANIC THIN FILM TRANSISTORS WITH MODIFIED SURFACE OF GATE-DIELECTRIC 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-09-18 WO disclosed
EP-0450862-B1 Organic thin film element TOSHIBA KK (JP) 1999-06-30 EP disclosed
US-5155566-A ORGANIC THIN FILM ELEMENT KABUSHIKI KAISHA TOSHIBA (JP) 1992-10-13 US disclosed
EP-0450862-A2 Organic thin film element KABUSHIKI KAISHA TOSHIBA (JP) 1991-10-09 EP disclosed
EP-0172427-B1 PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER Shin-Etsu Chemical Co., Ltd. (JP) 1989-07-05 EP disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP disclosed
EP-0039085-A1 Process for increasing the solubility of aromatic systems Langhals, Heinz, Dr. (DE) 1981-11-04 EP disclosed