SCHEMBL8606909

SCHEMBL8606909

CC(O)OC(=O)CCP(=O)(O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
CFTR P13569 1/20 0.53
POLB P06746 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
PKM P14618 1/20 0.40
TSHR P16473 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL9011403 0.82 ALDH1A1 (0.39) ALDH1A1CFTRPOLBSMN1; SMN2PKM
SCHEMBL4558544 0.81 CFTR (0.60) ALDH1A1CFTRPOLBSMN1; SMN2PKM
SCHEMBL7616535 0.78 SMN1; SMN2 (0.61) ALDH1A1CFTRPOLBSMN1; SMN2PKM
SCHEMBL65139 0.75 CFTR (0.72) ALDH1A1CFTRTSHRMEN1KMT2A
SCHEMBL19773247 0.75 CFTR (0.72) ALDH1A1CFTRTSHRMEN1KMT2A
SCHEMBL258599 0.74 ALDH1A1 (0.44) ALDH1A1CFTRPOLBSMN1; SMN2PKM
SCHEMBL5530286 0.74 CFTR (0.55) ALDH1A1CFTRPOLBSMN1; SMN2PKM
SCHEMBL6767415 0.74 ALDH1A1 (0.77) ALDH1A1CFTRL3MBTL1MEN1KMT2A
SCHEMBL7616480 0.74 CFTR (0.50) ALDH1A1CFTRPOLBSMN1; SMN2PKM
SCHEMBL13498174 0.74 CFTR (0.50) ALDH1A1CFTRPOLBSMN1; SMN2PKM

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-5710308-A Process for producing ogranophosphorus ester compound and reactive flame retardant SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1998-01-20 US disclosed
EP-0742224-A1 PROCESS FOR PRODUCING ORGANOPHOSPHORUS ESTER COMPOUND AND REACTIVE FLAME RETARDANT SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1996-11-13 EP disclosed