SCHEMBL25752842

SCHEMBL25752842

CC(C)(O)CCCNC(=O)C(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
DRD4 P21917 10/20 0.41
DRD2 P14416 8/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
EPHX1 P07099 1/20 0.38
CA12 O43570 1/20 0.36
CA2 P00918 1/20 0.36
CA3 P07451 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 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
SCHEMBL13617071 0.84 POLB (0.50) POLBALDH1A1SMN1; SMN2DRD4DRD2
SCHEMBL9355210 0.84 POLB (0.57) POLBALDH1A1SMN1; SMN2DRD4DRD2
SCHEMBL18622113 0.84 POLB (0.57) POLBALDH1A1SMN1; SMN2DRD4DRD2
SCHEMBL10633351 0.81 MEN1 (0.58) POLBALDH1A1SMN1; SMN2DRD4DRD2
SCHEMBL5795037 0.80 ALDH1A1 (0.39) POLBALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL18407564 0.79 FDPS (0.48) POLBDRD4DRD2KDM4EMAPT
SCHEMBL14330406 0.78 POLB (0.49) POLBALDH1A1SMN1; SMN2DRD4DRD2
SCHEMBL16316312 0.78 POLB (0.50) POLBALDH1A1SMN1; SMN2DRD4DRD2
SCHEMBL19991971 0.78 POLB (0.45) POLBALDH1A1SMN1; SMN2DRD4DRD2
SCHEMBL2025563 0.77 POLB (0.52) POLBALDH1A1SMN1; SMN2DRD4DRD2

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
US-11685835-B2 Ultra bright dimeric or polymeric dyes SONY CORPORATION (JP) 2023-06-27 US disclosed