SCHEMBL11348454

SCHEMBL11348454

O=S(=O)(O)CCCOCCO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
MAPK1 P28482 1/20 0.48
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
APP P05067 1/20 0.42
HTT P42858 2/20 0.41
MAPT P10636 2/20 0.41
THRB P10828 1/20 0.41
ALDH1A1 P00352 3/20 0.35
LMNA P02545 3/20 0.35
BLM P54132 2/20 0.35
PTGS1 P23219 1/20 0.35
PDE4A P27815 1/20 0.35
SLC6A6 P31641 1/20 0.35
CYP2C19 P33261 1/20 0.35
POLB P06746 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL29437894 0.98 MEN1 (0.50) TSHRMAPK1MEN1KMT2AAPP
SCHEMBL8384077 0.98 MEN1 (0.50) TSHRMAPK1MEN1KMT2AAPP
SCHEMBL8532305 0.98 TSHR (0.46) TSHRMAPK1MEN1KMT2AAPP
SCHEMBL8529768 0.96 MEN1 (0.48) TSHRMAPK1MEN1KMT2AAPP
SCHEMBL16589837 0.91 MEN1 (0.48) TSHRMAPK1MEN1KMT2AAPP
SCHEMBL421993 0.90 APP (0.50) TSHRAPPHTTMAPTALDH1A1
SCHEMBL25299218 0.87 APP (0.48) TSHRMEN1KMT2AAPPHTT
SCHEMBL22160261 0.87 APP (0.48) TSHRMEN1KMT2AAPPHTT
SCHEMBL20875302 0.87 APP (0.48) APPLMNABLMPTGS1PDE4A
SCHEMBL4731267 0.87 APP (0.48) APPLMNABLMPTGS1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4307185-A SENSITIZING DYE OF CYANINE STRUCTURE FUJI PHOTO FILM CO., LTD. (JP) 1981-12-22 US disclosed
US-4040840-A MEROCYANINE DYE HAVING ISOXAZOLE NUCLEUS AND PYRAZOLINE-5-ONE NUCLEUSN FUJI PHOTO FILM CO., LTD. (JA) 1977-08-09 US disclosed
US-4028112-A MEROCYANINE DYE WITH OXAZOLE NUCLEUS FUJI PHOTO FILM CO., LTD. (JA) 1977-06-07 US disclosed