SCHEMBL9682862

SCHEMBL9682862

CN(CCO)C(=O)N(CCO)CCO

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA4 P43681 1/20 0.37
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
CNR1 P21554 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALDH2 P05091 1/20 0.33

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
SCHEMBL9683914 0.86 MAPT (0.47) MAPTCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL1526065 0.81 MAPT (0.43) MAPTCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL193410 0.80 CA12 (0.43) MAPTCA12CA1CA2CA9
SCHEMBL11535736 0.80 CNR1 (0.43) CA12CA1CA2CA9CNR1
SCHEMBL14557535 0.79 MAPT (0.41) MAPTCA12CA1CA2CA9
SCHEMBL16309322 0.75 MAPT (0.47) MAPTCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL11412702 0.74 CA12 (0.48) CA12CA1CA2CA9ALDH1A1
SCHEMBL307669 0.72
SCHEMBL50119 0.72
SCHEMBL16693963 0.72 MAPT (0.35) MAPTCHRNB2CHRNB4CHRNA3CHRNA4

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 4 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-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