SCHEMBL5046477

SCHEMBL5046477

[O]C[C@H]1CCCN1C(=O)CO

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
DPP4 P27487 3/20 0.38
DPP8 Q6V1X1 2/20 0.38
PREP P48147 2/20 0.37
FAP Q12884 2/20 0.37
DPP9 Q86TI2 1/20 0.37
CHRM2 P08172 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM1 P11229 2/20 0.36
CHRM3 P20309 2/20 0.36
ACE P12821 1/20 0.35

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
SCHEMBL3431495 1.00 POLB (0.52) POLBL3MBTL1DPP4DPP8PREP
SCHEMBL3427333 1.00 POLB (0.52) POLBL3MBTL1DPP4DPP8PREP
SCHEMBL1712666 0.86 POLB (0.70) POLBL3MBTL1DPP4DPP8PREP
SCHEMBL5046483 0.86 POLB (0.70) POLBL3MBTL1DPP4DPP8PREP
SCHEMBL3431498 0.86 POLB (0.70) POLBL3MBTL1DPP4DPP8PREP
SCHEMBL13726715 0.78 POLB (0.46) POLBL3MBTL1DPP4DPP8PREP
SCHEMBL3430695 0.78 PREP (0.46) POLBL3MBTL1DPP4DPP8PREP
SCHEMBL3151491 0.78 POLB (0.48) POLBL3MBTL1CHRM2CHRM4CHRM1
SCHEMBL10667417 0.77 ALDH1A1 (0.54) POLBL3MBTL1
SCHEMBL1712663 0.76 POLB (0.68) POLBL3MBTL1DPP4DPP8PREP

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