SCHEMBL4553797

SCHEMBL4553797

C=C(CCC)C(=C)C(=C)C(=C)C(=C)C(=C)C(C(N)=O)C(N)=O

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.30
CES1 P23141 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
SCHEMBL8972383 0.88 CES2 (0.36) CES2CES1
SCHEMBL3839643 0.78 TDP1 (0.36) CES2CES1
SCHEMBL29113989 0.76
SCHEMBL28078307 0.74 CA1 (0.34) CES2CES1
SCHEMBL17818504 0.71 MEN1 (0.38) CES2CES1
SCHEMBL19620382 0.68 CES2 (0.30) CES2CES1
SCHEMBL422556 0.68
SCHEMBL3738395 0.67 CES1 (0.41) CES2CES1
SCHEMBL10823979 0.67 CES2 (0.33) CES2CES1
SCHEMBL28480406 0.66 HDAC3 (0.46) CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0180671-B1 PROTECTIVE CLOTHING E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-09-28 EP claimed
EP-0037744-B1 PROTECTIVE CLOTHING FOR CONFINING TOXIC COMPOUNDS USING FILM OF HIGHLY FLUORINATED ION EXCHANGE POLYMER E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-07-04 EP claimed
EP-0037745-B1 WATERPROOF PROTECTIVE COVERS COMPRISING A FILM OF HIGHLY FLUORINATED ION EXCHANGE POLYMER E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-06-27 EP claimed
US-20090044906-A1 METHOD FOR DECORATING SURFACES EVONIK DEGUSSA GMBH (DE) 2009-02-19 US disclosed
US-20080217821-A1 Welding Method by Means of Electromagnetic Radiation EVONIK DEGUSSA GMBH (DE) 2008-09-11 US disclosed