SCHEMBL10797709

SCHEMBL10797709

CN(C(=O)Oc1ccc(Cl)c(C(C)(C)C)c1)c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.43
MAPT P10636 2/20 0.43
LIPE Q05469 7/20 0.42
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ACHE P22303 1/20 0.40
NR1H4 Q96RI1 3/20 0.39
NPC1 O15118 2/20 0.39
POLB P06746 1/20 0.38
ALDH1A1 P00352 2/20 0.37

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
SCHEMBL10797783 0.89 SMN1; SMN2 (0.56) RAB9AMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL10797465 0.87 RAB9A (0.63) RAB9AMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL10802972 0.87 RAB9A (0.47) RAB9AMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL10804084 0.84 RAB9A (0.43) RAB9AMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL10803257 0.84 RAB9A (0.43) RAB9AMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL10802248 0.84 RAB9A (0.45) RAB9AMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL10797787 0.81 LIPE (0.52) RAB9AMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL10803442 0.81 LIPE (0.49) RAB9AMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL10797181 0.81 POLB (0.46) RAB9AMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL10803302 0.80 RAB9A (0.47) RAB9AMEN1KMT2ANPSR1SMN1; SMN2

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-4668831-A 3-TERTIARY-BUTYLPHENOL, SULFURYL CHLORIDE TOYO SODA MANUFACTURING CO., LTD. (JP) 1987-05-26 US disclosed
EP-0173993-A1 Tert-butyl-halophenol TOYO SODA MANUFACTURING CO., LTD. (JP) 1986-03-12 EP disclosed