SCHEMBL13448552

SCHEMBL13448552

O=C(I)OCCN1CCCC1=O

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.48
TSHR P16473 2/20 0.47
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 2/20 0.41
PIK3CD O00329 1/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.39
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL11890778 0.86 TSHR (0.50) POLBTSHRKMT2AMEN1SMN1; SMN2
SCHEMBL17387566 0.84 POLB (0.52) POLBTSHRKMT2AMEN1SMN1; SMN2
SCHEMBL17057352 0.83 TSHR (0.56) POLBTSHRKMT2AMEN1SMN1; SMN2
SCHEMBL6938181 0.83 KMT2A (0.50) POLBTSHRKMT2AMEN1SMN1; SMN2
SCHEMBL402936 0.81 POLB (0.47) POLBTSHRKMT2AMEN1SMN1; SMN2
SCHEMBL26972369 0.81 POLB (0.47) POLBTSHRKMT2AMEN1SMN1; SMN2
SCHEMBL16093641 0.81 POLB (0.47) POLBTSHRKMT2AMEN1SMN1; SMN2
SCHEMBL24774944 0.80 PIK3CD (0.50) POLBTSHRKMT2AMEN1SMN1; SMN2
SCHEMBL14865347 0.80 POLB (0.49) POLBTSHRKMT2AMEN1SMN1; SMN2
SCHEMBL13713464 0.80 POLB (0.49) POLBTSHRKMT2AMEN1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010033447-A2 COMPOSITION CONTAINING HETEROCYCLIC COMPOUNDS AND A METHOD OF LUBRICATING AN INTERNAL COMBUSTION ENGINE THE LUBRIZOL CORPORATION (US) 2010-03-25 WO disclosed