SCHEMBL7623977

SCHEMBL7623977

[CH2]CCCCCCCOOC(=O)c1ccccc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 4/20 0.45
HTT P42858 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
HSP90AA1 P07900 2/20 0.45
CTSD P07339 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC1 Q13547 1/20 0.43
HPGD P15428 4/20 0.43
ALDH1A1 P00352 4/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
XBP1 P17861 1/20 0.41
KCNK3 O14649 1/20 0.40
KCNK9 Q9NPC2 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
SCHEMBL7632101 1.00 SMN1; SMN2 (0.47) SMN1; SMN2LMNAMAPTHTTNPSR1
SCHEMBL7631853 1.00 SMN1; SMN2 (0.47) SMN1; SMN2LMNAMAPTHTTNPSR1
SCHEMBL7631198 1.00 SMN1; SMN2 (0.47) SMN1; SMN2LMNAMAPTHTTNPSR1
SCHEMBL7630520 1.00 SMN1; SMN2 (0.47) SMN1; SMN2LMNAMAPTHTTNPSR1
SCHEMBL7634177 1.00 SMN1; SMN2 (0.47) SMN1; SMN2LMNAMAPTHTTNPSR1
SCHEMBL7632823 1.00 SMN1; SMN2 (0.47) SMN1; SMN2LMNAMAPTHTTNPSR1
SCHEMBL7625712 0.99 SMN1; SMN2 (0.48) SMN1; SMN2LMNAMAPTHTTNPSR1
SCHEMBL7636318 0.94 MAPT (0.47) SMN1; SMN2LMNAMAPTHTTNPSR1
SCHEMBL7632304 0.88 CTSD (0.49) SMN1; SMN2LMNAMAPTHTTNPSR1
SCHEMBL7626620 0.88 HPGD (0.48) SMN1; SMN2LMNAHTTL3MBTL1HPGD

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
EP-1233014-A1 ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME NOF CORPORATION (JP) 2002-08-21 EP disclosed