SCHEMBL7930419

SCHEMBL7930419

C=C(C)c1c(C)cc(C)c(N=C=O)c1C

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.33
TRPA1 O75762 1/20 0.33
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31

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
SCHEMBL8677786 0.86 CYP3A4 (0.33) CYP3A4TRPA1GABRA1GABRB2
SCHEMBL16895247 0.79 CYP3A4 (0.33) CYP3A4TRPA1GABRA1GABRB2
SCHEMBL441816 0.79 CYP3A4 (0.43) CYP3A4TRPA1GABRA1GABRB2
SCHEMBL2679722 0.78 CYP3A4 (0.32) CYP3A4GABRA1GABRB2
SCHEMBL16707385 0.75 CYP3A4 (0.40) CYP3A4TRPA1GABRA1GABRB2
SCHEMBL4306324 0.72 CYP3A4 (0.43) CYP3A4TRPA1GABRA1GABRB2
SCHEMBL4650522 0.72 CYP3A4 (0.33) CYP3A4TRPA1GABRA1GABRB2
SCHEMBL1836129 0.72 CYP3A4 (0.48) CYP3A4TRPA1
SCHEMBL14493733 0.72 CYP3A4 (0.38) CYP3A4TRPA1GABRA1GABRB2
SCHEMBL1869910 0.71 CYP3A4 (0.40) CYP3A4TRPA1GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0452786-B1 Process for making multilayer coatings DU PONT (US) 2001-01-31 EP disclosed
US-5721018-A Method for producing multilayer coatings HERBERTS GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-02-24 US disclosed
US-5569705-A POLYURETHANE RESINS HAVING INTRODUCED DOUBLE BONDS; AUTOMOBILE LACQUERS HERBERTS GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1996-10-29 US disclosed
EP-0538719-B1 Process for making multilayers coating HERBERTS & CO GMBH (DE) 1996-04-10 EP disclosed
EP-0669356-A1 Aqueous polyurethane resin dispersion, its preparation and the appropriate polyurethane macromers, and their use in aqueous coatings Herberts Gesellschaft mit beschränkter Haftung (DE) 1995-08-30 EP disclosed
US-5395659-A Cationic polymers, clear coats, automobiles HERBERTS GMBH (DE) 1995-03-07 US disclosed
EP-0538719-A1 Process for making multilayers coating Herberts Gesellschaft mit beschränkter Haftung (DE) 1993-04-28 EP disclosed
EP-0452786-A2 Process for making multilayer coatings Herberts Gesellschaft mit beschränkter Haftung (DE) 1991-10-23 EP disclosed