SCHEMBL7640790

SCHEMBL7640790

C=CCC1(C/C=C(\C)CO)C(=O)NC(=O)NC1=O

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 1/20 0.39
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.34
PNLIP P16233 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
SCHEMBL7640794 1.00 MMP9 (0.39) MMP9LMNATP53PNLIP
SCHEMBL7646655 0.85 MMP9 (0.41) MMP9LMNATP53
Allobarbital SCHEMBL1887977 0.83 LMNA (0.50) MMP9LMNATP53
SCHEMBL9189636 0.81 TP53 (0.36) LMNATP53PNLIP
SCHEMBL9189643 0.81 TP53 (0.36) LMNATP53PNLIP
Allobarbital SCHEMBL35976 0.80 LMNA (0.48) MMP9LMNATP53
Allobarbital SCHEMBL11484021 0.78 LMNA (0.46) MMP9LMNATP53
Allobarbital SCHEMBL10817112 0.75 MMP9 (0.41) MMP9LMNATP53
Etallobarbital SCHEMBL713588 0.73 LMNA (0.64) MMP9LMNATP53
SCHEMBL2048015 0.73 MMP9 (0.42) MMP9LMNATP53

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-0457213-B1 Barbiturate assay, tracers, immunogens, antibodies and kit ABBOTT LAB (US) 1997-07-23 EP claimed
US-6472227-B1 A FLUORESCEIN MOIETY IS INCLUDED IN THE TRACER, WHILE A POLY(AMINO ACID) FORMS A PART OF THE IMMUNOGEN FOR DETERMINING THE AMOUNT OF BARBITURATE IN FLUIDS, ESPECIALLY BIOLOGICAL FLUIDS SUCH AS SERUM, PLASMA OR URINE ABBOTT LABORATORIES 2002-10-29 US disclosed
EP-0457213-B1 Barbiturate assay, tracers, immunogens, antibodies and kit ABBOTT LAB (US) 1997-07-23 EP disclosed
EP-0430065-B1 Barbiturate assay compositions and methods ABBOTT LAB (US) 1995-11-15 EP disclosed
US-5099020-A Immunoassay with fluorescent compounds ABBOTT LABORATORIES (US) 1992-03-24 US disclosed
US-5096838-A Fluorescent tracers for detection of barbiturates and for antiserums ABBOTT LABORATORIES (US) 1992-03-17 US disclosed
EP-0457213-A2 Barbiturate assay, tracers, immunogens, antibodies and kit ABBOTT LABORATORIES (US) 1991-11-21 EP disclosed
EP-0430065-A2 Barbiturate assay compositions and methods ABBOTT LABORATORIES (US) 1991-06-05 EP disclosed