SCHEMBL7858237

SCHEMBL7858237

CCCCCCCCN1C=CC=CC1C=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.33
PTGS2 P35354 3/20 0.33
MGLL Q99685 3/20 0.33
FAAH O00519 1/20 0.33
TSHR P16473 1/20 0.31
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
MAPT P10636 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HPGD P15428 1/20 0.31
APAF1 O14727 1/20 0.30
NPC1 O15118 1/20 0.30
PLA2G1B P04054 1/20 0.30
HSP90AA1 P07900 1/20 0.30
MAPK1 P28482 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 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
Hydrochloric Acid SCHEMBL28906736 0.82 TSHR (0.34) TSHRMEN1KMT2AMAPTTDP1
SCHEMBL27517593 0.77 EBP (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL27713577 0.77 EBP (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL27734061 0.77 EBP (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL27558466 0.77 EBP (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL27517256 0.77 EBP (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL27713571 0.77 EBP (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL27909615 0.77 EBP (0.36) PTGS1PTGS2MGLLFAAHTSHR
SCHEMBL27523469 0.77 EBP (0.36) PTGS1PTGS2MGLLFAAHTSHR
Hydrochloric Acid SCHEMBL28759130 0.75 EBP (0.35) PTGS1PTGS2MGLLFAAHNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001007496-A2 POLYMERS, THEIR PRECURSORS AND PROCESSES FOR PREPARATION THEREOF BP CHEMICALS LIMITED (GB) 2001-02-01 WO disclosed