SCHEMBL27791997

SCHEMBL27791997

O=C(O)C1=CC=CN(CCCCc2ccccc2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.43
FAAH O00519 1/20 0.41
MGLL Q99685 1/20 0.41
MAPT P10636 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
NAMPT P43490 2/20 0.40
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
CCR3 P51677 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HDAC3 O15379 1/20 0.39
MAPK1 P28482 1/20 0.39
ADRA1A P35348 1/20 0.39
HDAC4 P56524 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HDAC1 Q13547 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39

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
SCHEMBL27791887 0.99 SIGMAR1 (0.43) SIGMAR1FAAHMGLLMAPTRXFP1
SCHEMBL27770866 0.96 SIGMAR1 (0.43) SIGMAR1FAAHMAPTRXFP1NAMPT
SCHEMBL28784836 0.90 MEN1 (0.39) SIGMAR1MGLLMAPTGSK3AGSK3B
SCHEMBL29067685 0.78 PLA2G2A (0.36) FAAHMGLL
SCHEMBL29061000 0.78 HCAR3 (0.34) TDP1MAPK1
Bromide SCHEMBL29059984 0.77 HCAR3 (0.33) TDP1MAPK1
SCHEMBL28799517 0.71 TSHR (0.34) TDP1MAPK1
SCHEMBL29060999 0.71 TSHR (0.34) TDP1MAPK1
SCHEMBL2353804 0.70 PARP1 (0.40) HDAC8
SCHEMBL27814642 0.70 LMNA (0.43) L3MBTL1SMN1; SMN2HDAC8

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
CN-101634021-B Electroless gold plating solution ROHM & HAAS ELECT MAT 2012-11-07 CN disclosed
CN-101634021-A Electroless gold plating solution ROHM & HAAS ELECT MAT 2010-01-27 CN disclosed