SCHEMBL234807

SCHEMBL234807

CCCCCCCCCCCCCCCCCCCCCCC(CC)CCC=CCCCc1cccc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 3/20 0.39
F3 P13726 3/20 0.39
MMP2 P08253 2/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39
ECE1 P42892 1/20 0.39
SGMS1 Q86VZ5 1/20 0.39
SGMS2 Q8NHU3 1/20 0.39
MUS81 Q96NY9 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SAE1 Q9UBE0 1/20 0.39
BCHE P06276 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
BID P55957 3/20 0.37
BCL2L1 Q07817 3/20 0.37
MCL1 Q07820 3/20 0.37
BAK1 Q16611 3/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL234806 0.78 CHAT (0.48) KDM4EKMT2AL3MBTL1PRSS1PRSS2
SCHEMBL284785 0.77 LIPG (0.55) MAPTBCHESIGMAR1CNR1TAAR1
SCHEMBL422811 0.77 LIPG (0.55) MAPTBCHESIGMAR1CNR1TAAR1
SCHEMBL284556 0.77 LIPG (0.55) MAPTBCHESIGMAR1CNR1TAAR1
SCHEMBL284581 0.77 LIPG (0.55) MAPTBCHESIGMAR1CNR1TAAR1
SCHEMBL1798754 0.77 LIPG (0.55) MAPTBCHESIGMAR1CNR1TAAR1
SCHEMBL283950 0.77 LIPG (0.55) MAPTBCHESIGMAR1CNR1TAAR1
SCHEMBL599120 0.77 LIPG (0.55) MAPTBCHESIGMAR1CNR1TAAR1
SCHEMBL284530 0.77 LIPG (0.55) MAPTBCHESIGMAR1CNR1TAAR1
SCHEMBL283928 0.77 LIPG (0.55) MAPTBCHESIGMAR1CNR1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8445571-B2 Processing agent for polyurethane elastomer fibers TAKEMOTO YUSHI KABUSHIKI KAISHA (JP) 2013-05-21 US disclosed
US-20120004352-A1 POLYURETHANE ELASTOMER FIBERS AND PROCESSING AGENT AND METHOD THEREFOR TAKEMOTO YUSHI KABUSHIKI KAISHA (JP) 2012-01-05 US disclosed