SCHEMBL7639692

SCHEMBL7639692

OC(Br)CC1CCCCO1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HPGD P15428 4/20 0.36
TP53 P04637 1/20 0.36
ALOX12 P18054 1/20 0.36
KMT2A Q03164 3/20 0.35
HTT P42858 1/20 0.34
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
ANPEP P15144 1/20 0.33
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL6137050 0.80 USP2 (0.35) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL8863690 0.79 USP2 (0.37) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL23501590 0.79 USP2 (0.37) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL28037271 0.78 LMNA (0.33) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL11782848 0.78 USP2 (0.36) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL22145206 0.77 USP2 (0.40) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL29018459 0.77 USP2 (0.40) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL8208318 0.76
SCHEMBL11025614 0.75 USP2 (0.34) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL4888352 0.75 USP2 (0.41) USP2SMN1; SMN2HPGDTP53ALOX12

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-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-0457213-A2 Barbiturate assay, tracers, immunogens, antibodies and kit ABBOTT LABORATORIES (US) 1991-11-21 EP disclosed
EP-0373508-A2 Barbiturate assay, tracers, immunogens and antibodies ABBOTT LABORATORIES (US) 1990-06-20 EP disclosed