SCHEMBL9681841

SCHEMBL9681841

CCCNC(=O)OCC(C)O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.53
CHRNB4 P30926 1/20 0.53
CHRNA3 P32297 1/20 0.53
CHRNA4 P43681 1/20 0.53
ACHE P22303 10/20 0.47
ALOX15 P16050 1/20 0.46
MAPT P10636 2/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
ALDH1A1 P00352 1/20 0.41
ATM Q13315 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL6287763 0.89 ACHE (0.63) ACHEALOX15MAPT
SCHEMBL8381807 0.86 SMN1; SMN2 (0.54) CHRNB2CHRNB4CHRNA3CHRNA4ACHE
SCHEMBL10749335 0.84 CHRNB2 (0.53) CHRNB2CHRNB4CHRNA3CHRNA4ACHE
SCHEMBL5247558 0.83 SMN1; SMN2 (0.56) CHRNB2CHRNB4CHRNA3CHRNA4ACHE
SCHEMBL13681838 0.83 SMN1; SMN2 (0.56) CHRNB2CHRNB4CHRNA3CHRNA4ACHE
SCHEMBL7366433 0.82 CHRNB2 (0.51) CHRNB2CHRNB4CHRNA3CHRNA4ACHE
SCHEMBL17790870 0.81 MEN1 (0.49) CHRNB2CHRNB4CHRNA3CHRNA4ACHE
SCHEMBL20927998 0.80 CHRNB2 (0.49) CHRNB2CHRNB4CHRNA3CHRNA4ACHE
SCHEMBL14984014 0.79 CHRNB2 (0.49) CHRNB2CHRNB4CHRNA3CHRNA4ACHE
SCHEMBL8373589 0.79 MAPT (0.40) CHRNB2CHRNB4CHRNA3CHRNA4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5158808-A Method of coating with a water borne composition UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1992-10-27 US disclosed
US-5039759-A Water borne high solids coating compositions TECHNOLOGY CORPORATION UNITED CARBIDE CHEMICALS AND PLASTICS (US) 1991-08-13 US disclosed
EP-0212380-B1 AQUEOUS HIGH SOLIDS COATING COMPOSITIONS UNION CARBIDE CORPORATION (US) 1990-09-19 EP disclosed
EP-0233253-A1 CARBAMATE COATING COMPOSITIONS UNION CARBIDE CORPORATION (US) 1987-08-26 EP disclosed
US-4677168-A Water borne high solids coating compositions UNION CARBIDE CORPORATION, 1987-06-30 US disclosed
EP-0212380-A2 Aqueous high solids coating compositions UNION CARBIDE CORPORATION (US) 1987-03-04 EP disclosed
EP-0211359-A1 High solids coating compositions UNION CARBIDE CORPORATION (US) 1987-02-25 EP disclosed
WO-1987000851-A1 CARBAMATE COATING COMPOSITIONS UNION CARBIDE CORPORATION (US) 1987-02-12 WO disclosed
EP-0196112-A2 Aqueous high solids coating compositions UNION CARBIDE CORPORATION (US) 1986-10-01 EP disclosed