SCHEMBL2789591

SCHEMBL2789591

O=C(O)Cc1c(Br)c(O)cc(O)c1Br

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.42
KDM4E B2RXH2 2/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
POLB P06746 2/20 0.42
TSHR P16473 2/20 0.42
NFKB1 P19838 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
RGS12 O14924 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
APEX1 P27695 1/20 0.42
THPO P40225 1/20 0.42
BLM P54132 1/20 0.42
GNAI1 P63096 1/20 0.42
PMP22 Q01453 1/20 0.42
HIF1A Q16665 1/20 0.42
AKR1B1 P15121 4/20 0.40
ALDH1A1 P00352 2/20 0.40
GLA P06280 1/20 0.40

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
SCHEMBL4380223 0.80 SMN1; SMN2 (0.42) GAAKDM4EHPGDHSD17B10POLB
SCHEMBL9117601 0.75 F11 (0.46) GAAKDM4EHPGDHSD17B10POLB
SCHEMBL9241452 0.72 PTPN1 (0.52) GAAKDM4EHPGDHSD17B10POLB
SCHEMBL20983221 0.71 POLB (0.52) GAAKDM4EHPGDHSD17B10POLB
SCHEMBL4928410 0.71 GPR17 (0.43) GAAKDM4EHPGDHSD17B10POLB
SCHEMBL7128691 0.70 GAA (0.61) GAAKDM4EHPGDHSD17B10POLB
SCHEMBL10759270 0.70 GAA (0.39) GAAKDM4EHPGDHSD17B10POLB
SCHEMBL9235372 0.70 CA2 (0.42) GAAKDM4EHPGDHSD17B10HIF1A
SCHEMBL9658959 0.70 AKR1B1 (0.46) HSD17B10TSHRTDP1AKR1B1CSNK2A2
SCHEMBL31310136 0.70 GPR17 (0.39) GAAKDM4EHPGDHSD17B10POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524966-B2 Method for preparing ladderanes UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2009-04-28 US claimed
US-20090088572-A1 METHOD FOR PREPARING LADDERANES NATIONAL SCIENCE FOUNDATION 2009-04-02 US claimed
WO-2007089785-A2 APPARATUS AND SEMICONDUCTOR CO-CRYSTAL UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2007-08-09 WO claimed
WO-2005035473-A2 METHOD FOR PREPARING LADDERANES FROM PRE-ORIENTED POLYENES UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2005-04-21 WO claimed
US-8328933-B2 Apparatus and semiconductor co-crystal UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2012-12-11 US disclosed
US-20100148154-A1 APPARATUS AND SEMICONDUCTOR CO-CRYSTAL UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2010-06-17 US disclosed
US-7524966-B2 Method for preparing ladderanes UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2009-04-28 US disclosed
US-7524373-B2 Apparatus and semiconductor co-crystal UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2009-04-28 US disclosed
US-20090088572-A1 METHOD FOR PREPARING LADDERANES NATIONAL SCIENCE FOUNDATION 2009-04-02 US disclosed
WO-2007089785-A2 APPARATUS AND SEMICONDUCTOR CO-CRYSTAL UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2007-08-09 WO disclosed
US-20070178621-A1 Apparatus and semiconductor co-crystal UNIVERISTY OF IOWA RESEARCH FOUNDATION 2007-08-02 US disclosed
WO-2005035473-A2 METHOD FOR PREPARING LADDERANES FROM PRE-ORIENTED POLYENES UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2005-04-21 WO disclosed