SCHEMBL7590658

SCHEMBL7590658

CCCCC1(C(=O)O)C(=O)N(c2ccccc2)C(=O)N1c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.56
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SLC6A2 P23975 2/20 0.37
LMNA P02545 4/20 0.37
HTT P42858 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 2/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 2/20 0.36
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36
USP2 O75604 1/20 0.36
HSP90AA1 P07900 1/20 0.36

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
SCHEMBL10952562 0.72 ELANE (1.00) ELANEKDM4EPKMCYP2C19SMN1; SMN2
SCHEMBL19923423 0.70 ELANE (0.61) ELANESMN1; SMN2
SCHEMBL11800500 0.69 ELANE (0.42) ELANECYP2C19NPC1GAA
SCHEMBL11790893 0.68 ELANE (0.45) ELANEKDM4EPKMALDH1A1GAA
SCHEMBL19923441 0.68 GRM4 (0.57) ELANEALDH1A1GAA
SCHEMBL9457060 0.68 KDM4E (0.61) ELANEKDM4EPKMCYP2C19SMN1; SMN2
SCHEMBL9726893 0.68 ELANE (0.49) ELANEKDM4EPKMCYP2C19SMN1; SMN2
SCHEMBL19693968 0.68 ELANE (0.43) ELANEKDM4EPKMLMNAMEN1
SCHEMBL19923452 0.67 ELANE (0.56) ELANECYP2C19SMN1; SMN2LMNAMEN1
SCHEMBL19923463 0.66 ELANE (0.46) ELANESMN1; SMN2NPC1RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0593956-B1 Agglutination assays using multivalent ligands DADE BEHRING INC (US) 2002-02-13 EP disclosed
US-5401636-A Enhanced sensitivity agglutination assays multivalent ligands E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-03-28 US disclosed
EP-0593956-A2 Agglutination assays using multivalent ligands E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-04-27 EP disclosed