SCHEMBL8924131

SCHEMBL8924131

[CH2]COC(=O)C(C)NCC

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.33
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
CA14 Q9ULX7 1/20 0.30

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
SCHEMBL3598471 0.82 MGAM (0.44) MGAMGAASIMGAM2
SCHEMBL706893 0.79
SCHEMBL706892 0.79
SCHEMBL13650458 0.79
SCHEMBL10771721 0.78 SMN1; SMN2 (0.43) MGAMGAASIMGAM2
SCHEMBL31424894 0.77 ACHE (0.40) MGAMGAASIMGAM2CHRNB2
SCHEMBL20222504 0.76 TSHR (0.39) MGAMGAASIMGAM2CHRNB2
SCHEMBL4392446 0.76
SCHEMBL18162798 0.76 TSHR (0.39) MGAMGAASIMGAM2CHRNB2
SCHEMBL16155384 0.75 ALDH1A1 (0.48) ZDHHC7

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5639770-A SUPEROXIDE INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-06-17 US disclosed
EP-0600092-A1 THIAZOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-08 EP disclosed