SCHEMBL7501993

SCHEMBL7501993

CC/C(=C(/C)C(=O)O)N(C)C.CCC/C=C(\C(=O)O)N(C)C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.32
GRIK2 Q13002 1/20 0.32
FNTA P49354 1/20 0.30
FNTB P49356 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
SCHEMBL119322 0.84 GRIK1 (0.40) GRIK1GRIK2
SCHEMBL109778 0.80 ALDH1A1 (0.36) FNTAFNTB
SCHEMBL44909 0.80 ALDH1A1 (0.36) FNTAFNTB
Hydrochloric Acid SCHEMBL5177423 0.78 ALDH1A1 (0.35) FNTAFNTB
Acetic Acid SCHEMBL6238297 0.78 FFAR3 (0.35) FNTAFNTB
Hydrochloric Acid SCHEMBL27756695 0.78 ALDH1A1 (0.35) FNTAFNTB
Chloromethane SCHEMBL219837 0.77 ALDH1A1 (0.33) FNTAFNTB
Hydrochloric Acid SCHEMBL10569852 0.77 FFAR3 (0.33) FNTAFNTB
SCHEMBL4859236 0.75 FNTA (0.37) FNTAFNTB
Chloromethane SCHEMBL9414315 0.75 ALDH1A1 (0.32) FNTAFNTB

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
EP-1002811-B1 Soluble or water-dispersible graft copolymers based on a polyvinyllactam, the preparation and use thereof BASF AG (DE) 2002-02-13 EP disclosed
EP-1002811-A2 Soluble or water-dispersible graft copolymers based on a polyvinyllactam, the preparation and use thereof BASF AKTIENGESELLSCHAFT (DE) 2000-05-24 EP disclosed