SCHEMBL5046483

SCHEMBL5046483

O=C(CO)N1CCC[C@@H]1CO

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.70
L3MBTL1 Q9Y468 1/20 0.70
DPP4 P27487 4/20 0.49
DPP8 Q6V1X1 3/20 0.49
CHRM2 P08172 3/20 0.46
CHRM4 P08173 3/20 0.46
CHRM1 P11229 3/20 0.46
CHRM3 P20309 3/20 0.46
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PREP P48147 1/20 0.38
FAP Q12884 1/20 0.38
DPP9 Q86TI2 1/20 0.38
PDK2 Q15119 2/20 0.38
SPHK2 Q9NRA0 1/20 0.37
RAB9A P51151 1/20 0.37
EPHX2 P34913 1/20 0.37
VNN1 O95497 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
SCHEMBL1712666 1.00 POLB (0.70) POLBL3MBTL1DPP4DPP8CHRM2
SCHEMBL3431498 1.00 POLB (0.70) POLBL3MBTL1DPP4DPP8CHRM2
SCHEMBL1712663 0.86 POLB (0.68) POLBL3MBTL1DPP4DPP8CHRM2
SCHEMBL3427333 0.86 POLB (0.52) POLBL3MBTL1DPP4DPP8CHRM2
SCHEMBL5046477 0.86 POLB (0.52) POLBL3MBTL1DPP4DPP8CHRM2
SCHEMBL3431495 0.86 POLB (0.52) POLBL3MBTL1DPP4DPP8CHRM2
SCHEMBL12156743 0.84 POLB (0.66) POLBL3MBTL1DPP4DPP8CHRM2
SCHEMBL8573486 0.84 POLB (0.66) POLBL3MBTL1DPP4DPP8CHRM2
SCHEMBL10272735 0.84 POLB (0.66) POLBL3MBTL1DPP4DPP8CHRM2
SCHEMBL3831117 0.84 POLB (0.66) POLBL3MBTL1DPP4DPP8CHRM2

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-1613619-B1 QUINAZOLINE DERIVATIVES FOR TREATMENT OF CANCER ASTRAZENECA AB (SE) 2008-03-26 EP disclosed