SCHEMBL9429254

SCHEMBL9429254

CCN1CCN(C(=O)N[C@@H](C(=O)Cl)c2ccc(O[Si](C)(C)C)c(O[Si](C)(C)C)c2)C(=O)C1=O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ PDE3A Q14432 1/20 0.34
▸ SLC22A6 Q4U2R8 1/20 0.34
▸ SLC22A8 Q8TCC7 1/20 0.34
▸ SLC22A11 Q9NSA0 1/20 0.34
▸ THRB P10828 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ PDE2A O00408 2/20 0.31

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
SCHEMBL9429259 1.00 POLB (0.34) POLBMAPTPDE3ASLC22A6SLC22A8
SCHEMBL10530994 0.87 PDE3A (0.38) POLBMAPTPDE3ASLC22A6SLC22A8
SCHEMBL9770262 0.85 POLB (0.35) POLBMAPTPDE3ASLC22A6SLC22A8
SCHEMBL10403829 0.80 SMN1; SMN2 (0.44) SMN1; SMN2
SCHEMBL28435235 0.80 MAPT (0.43) POLBMAPTPDE3ASLC22A6SLC22A8
SCHEMBL28473803 0.80 MAPT (0.43) POLBMAPTPDE3ASLC22A6SLC22A8
SCHEMBL8600205 0.79 POLB (0.40) POLBMAPTPDE3ASLC22A6SLC22A8
SCHEMBL10543158 0.79 POLB (0.40) POLBMAPTPDE3ASLC22A6SLC22A8
SCHEMBL10490784 0.78 MAPT (0.37) POLBMAPTPDE3ASLC22A6SLC22A8
SCHEMBL10401867 0.76 TSHR (0.34) POLBMAPTPDE3ASLC22A6SLC22A8

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-5275816-A Cephalosporin derivatives BEECHAM GROUP P.L.C. (GB) 1994-01-04 — — US disclosed
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