SCHEMBL8743449

SCHEMBL8743449

c1ccc2cc3c4c(ccc3cc2c1)O4

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.44
HSD17B10 Q99714 7/20 0.44
HIF1A Q16665 2/20 0.44
CYP1B1 Q16678 1/20 0.44
MAOA P21397 2/20 0.38
MAOB P27338 1/20 0.38
KDM4E B2RXH2 4/20 0.37
GAA P10253 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
CYP3A4 P08684 2/20 0.37
ALOX15 P16050 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
HBB P68871 1/20 0.37
CYP1A2 P05177 5/20 0.36
AHR P35869 2/20 0.36
ERBB2 P04626 1/20 0.36
FYN P06241 1/20 0.36
ACHE P22303 1/20 0.36
CYP2A6 P11509 3/20 0.35

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
SCHEMBL9043839 0.85 MAOA (0.39) ALDH1A1HSD17B10HIF1ACYP1B1MAOA
SCHEMBL729622 0.79 HSD17B10 (0.52) ALDH1A1HSD17B10HIF1ACYP1B1KDM4E
SCHEMBL23633182 0.79 HSD17B10 (0.52) ALDH1A1HSD17B10HIF1ACYP1B1KDM4E
SCHEMBL13935933 0.77 ALDH1A1 (0.37) ALDH1A1HSD17B10HIF1ACYP1B1MAOA
SCHEMBL14159002 0.76 ITGB2 (0.41) ALDH1A1HSD17B10HIF1ACYP1B1MAOA
Ethylene SCHEMBL27918467 0.76 HSD17B10 (0.48) ALDH1A1HSD17B10HIF1ACYP1B1KDM4E
SCHEMBL23664 0.75 ALDH1A1 (0.72) ALDH1A1HSD17B10HIF1ACYP1B1MAOA
SCHEMBL29532882 0.75 ALDH1A1 (0.72) ALDH1A1HSD17B10HIF1ACYP1B1MAOA
SCHEMBL4848746 0.75 ALDH1A1 (0.72) ALDH1A1HSD17B10HIF1ACYP1B1MAOA
SCHEMBL4853659 0.75 ALDH1A1 (0.72) ALDH1A1HSD17B10HIF1ACYP1B1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108047243-A A kind of five butterfly alkene tetracarboxylic acid dianhydride compounds of 2,3,6,7- and its synthetic method 华侨大学 2018-05-18 CN claimed
CN-108047243-A A kind of five butterfly alkene tetracarboxylic acid dianhydride compounds of 2,3,6,7- and its synthetic method 华侨大学 2018-05-18 CN disclosed
US-5612188-A Automated, multicompartmental cell culture system CORNELL RESEARCH FOUNDATION, INC. (US) 1997-03-18 US disclosed
EP-0620939-A4 AUTOMATED MULTICOMPARTMENTAL CELL CULTURE SYSTEM. CORNELL RES FOUNDATION INC (US) 1996-05-29 EP disclosed
WO-1994028501-A1 AUTOMATED, MULTICOMPARTMENTAL CELL CULTURE SYSTEM CORNELL RESEARCH FOUNDATION, INC. (US) 1994-12-08 WO disclosed
EP-0620939-A1 AUTOMATED MULTICOMPARTMENTAL CELL CULTURE SYSTEM CORNELL RESEARCH FOUNDATION, INC. (US) 1994-10-26 EP disclosed
WO-1993011498-A1 AUTOMATED MULTICOMPARTMENTAL CELL CULTURE SYSTEM CORNELL RESEARCH FOUNDATION, INC. (US) 1993-06-10 WO disclosed
US-4705850-A C-glycosidic adriamycin analogs SRI INTERNATIONAL (US) 1987-11-10 US disclosed
EP-0202245-A1 C-GLYCOSIDIC ADRIAMYCIN ANALOGS SRI INTERNATIONAL (US) 1986-11-26 EP disclosed
WO-1986003201-A1 C-GLYCOSIDIC ADRIAMYCIN ANALOGS SRI INTERNATIONAL (US) 1986-06-05 WO disclosed