SCHEMBL5070664

SCHEMBL5070664

C=Cc1ccc(CCc2ccccc2C=C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
TSHR P16473 1/20 0.41
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
SLC5A1 P13866 1/20 0.34
SLC5A2 P31639 1/20 0.34
HTR1A P08908 1/20 0.33
DRD2 P14416 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.33
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
PSMD14 O00487 1/20 0.31
LMNA P02545 1/20 0.31
ABCB1 P08183 1/20 0.30
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 1/20 0.30
HIF1A Q16665 1/20 0.30
SLC6A2 P23975 1/20 0.30

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
SCHEMBL5070663 1.00 ALDH1A1 (0.41) ALDH1A1TSHRPOLBMAPTSLC5A1
SCHEMBL5135464 0.98 ALDH1A1 (0.40) ALDH1A1TSHRPOLBMAPTSLC5A1
SCHEMBL5663675 0.92 ALDH1A1 (0.41) ALDH1A1TSHRMAPTHTR1ADRD2
SCHEMBL5662980 0.92 MAOA (0.36) ALDH1A1TSHRPOLBMAPTHTR1A
SCHEMBL5664288 0.88 ALDH1A1 (0.48) ALDH1A1TSHRPOLBMAPTSLC5A1
SCHEMBL5073359 0.86 MAPT (0.45) ALDH1A1MAPTHTR1ADRD2MAOA
SCHEMBL5662273 0.85 TP53 (0.37) ALDH1A1TSHRMAPTHTR1ADRD2
SCHEMBL29377653 0.84 ALDH1A1 (0.48) ALDH1A1TSHRMAPTLMNA
SCHEMBL595200 0.84 ALDH1A1 (0.48) ALDH1A1TSHRMAPTLMNA
SCHEMBL28682859 0.83 SLC5A1 (0.43) ALDH1A1TSHRPOLBSLC5A1SLC5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966290-A2 POROUS MONOLITHIC ORGANIC COPOLYMER FOR BIOPOLYMER CHROMATOGRAPHY Leopold-Franzens-Universität Innsbruck (AT) 2008-09-10 EP disclosed
WO-2007073865-A2 POROUS MONOLITHIC ORGANIC COPOLYMER FOR BIOPOLYMER CHROMATOGRAPHY LEOPOLD-FRANZENS-UNIVERSITÄT INNSBRUCK (AT) 2007-07-05 WO disclosed
US-20070144972-A1 Monolithic Organic Copolymer for Biopolymer Chromatography LEOPOLD-FRANZENS-UNIVERSITAT INNSBRUCK (AT) 2007-06-28 US disclosed