SCHEMBL810262

SCHEMBL810262

C=Cc1cc(OCC)c(CCl)c2cc3ccccc3cc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 4/20 0.35
GAA P10253 2/20 0.35
TLR8 Q9NR97 1/20 0.35
ALOX5 P09917 1/20 0.33
NQO1 P15559 1/20 0.33
TP53 P04637 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KDM4E B2RXH2 2/20 0.32
LMNA P02545 3/20 0.31
SLC2A1 P11166 1/20 0.31
S1PR1 P21453 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
ALOX12 P18054 1/20 0.31
NTSR1 P30989 1/20 0.31
CCR6 P51684 1/20 0.31
MCL1 Q07820 1/20 0.31

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
SCHEMBL809845 0.88 L3MBTL1 (0.40) L3MBTL1GAATLR8SLC2A1
SCHEMBL809666 0.87 ALDH1A1 (0.38) L3MBTL1ALDH1A1GAATLR8ALOX5
SCHEMBL809812 0.86 NQO1 (0.45) L3MBTL1ALDH1A1NQO1TP53SMN1; SMN2
SCHEMBL809665 0.81 KMT2A (0.36) L3MBTL1ALDH1A1TP53SMN1; SMN2NPC1
SCHEMBL810002 0.79 L3MBTL1 (0.39) L3MBTL1ALDH1A1RAB9AMAPTCCR6
SCHEMBL809707 0.79 L3MBTL1 (0.41) L3MBTL1ALDH1A1NQO1RAB9AMAPT
SCHEMBL2516586 0.77 L3MBTL1 (0.42) L3MBTL1ALDH1A1RAB9AMAPTCCR6
SCHEMBL810000 0.77 L3MBTL1 (0.42) L3MBTL1ALDH1A1RAB9AMAPTCCR6
SCHEMBL809738 0.76 GAA (0.40) L3MBTL1ALDH1A1GAATLR8SMN1; SMN2
SCHEMBL809749 0.76 L3MBTL1 (0.41) L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012015977-A3 HIGHLY PORTABLE AND STABLE WORK STATION HERSCHLER MATTHEW B (US) 2012-05-10 WO disclosed
EP-2192645-B1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME TOKUYAMA CORP (JP) 2011-11-30 EP disclosed
US-20110250525-A1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME TOKUYAMA CORPORATION (JP) 2011-10-13 US disclosed
EP-2192645-A1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME Tokuyama Corporation (JP) 2010-06-02 EP disclosed