SCHEMBL7524932

SCHEMBL7524932

CCC1(c2ccccc2)C(=O)NC(=O)N(CCCCC(=O)N2CCN(C(=O)CCC(=O)OC3CC(=O)NC3=O)CC2)C1=O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.42
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.36
MMP2 P08253 11/20 0.35
MMP9 P14780 11/20 0.35
MMP8 P22894 10/20 0.35
MMP13 P45452 10/20 0.35
ADAMTS5 Q9UNA0 2/20 0.35
MMP1 P03956 1/20 0.35
NPC1 O15118 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL9301787 0.87 CYP2C19 (0.41) CYP2C19LMNAKMT2AALDH1A1SMN1; SMN2
SCHEMBL7803894 0.86 CYP2C19 (0.40) CYP2C19LMNAKMT2AALDH1A1SMN1; SMN2
SCHEMBL7813714 0.86 CYP2C19 (0.39) CYP2C19LMNAKMT2AALDH1A1NPC1
SCHEMBL7775183 0.84 CYP2C19 (0.51) CYP2C19LMNAKMT2AALDH1A1MMP2
SCHEMBL7028228 0.84 SIGMAR1 (0.46)
SCHEMBL7813558 0.81 CYP2C19 (0.44) CYP2C19LMNAKMT2AALDH1A1MMP2
SCHEMBL7775187 0.81 CYP2C19 (0.51) CYP2C19LMNAKMT2AALDH1A1MMP2
SCHEMBL7773261 0.79 CYP2C19 (0.50) CYP2C19LMNAKMT2AALDH1A1NPC1
SCHEMBL7045940 0.75 CYP2C19 (0.61) CYP2C19LMNAKMT2AMMP2MMP9
SCHEMBL9622341 0.75 CYP2C19 (0.61) CYP2C19LMNAKMT2AMMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0517325-B1 Drug hapten analogues for immunoassays JOHNSON & JOHNSON CLIN DIAG (US) 2001-10-31 EP claimed
EP-0685740-B1 Separation-free specific binding assays using anti-inhibitor antibodies JOHNSON & JOHNSON CLIN DIAG (US) 2002-04-03 EP disclosed
EP-0517325-B1 Drug hapten analogues for immunoassays JOHNSON & JOHNSON CLIN DIAG (US) 2001-10-31 EP disclosed
EP-0690071-B1 Inhibitor and anti-inhibitor monoclonal antibodies specific for horseradish peroxidase JOHNSON & JOHNSON CLIN DIAG (US) 2000-12-27 EP disclosed
US-5916757-A PROVIDES DIRECT CORRELATION OF GENERATED SIGNAL TO TARGET SPECIFIC BINDING LIGAND JOHNSON & JOHNSON CLINICAL DIAGNOSTICS, INC. (US) 1999-06-29 US disclosed
US-5601994-A Immunoassay with novel labeled drug hapten analogues JOHNSON & JOHNSON CLINICAL DIAGNOSTICS, INC. (US) 1997-02-11 US disclosed
EP-0690071-A2 Inhibitor and anti-inhibitor monoclonal antibodies specific for horseradish peroxidase Johnson & Johnson Clinical Diagnostics, Inc. (US) 1996-01-03 EP disclosed
EP-0685740-A2 Separation-free specific binding assays using anti-inhibitor antibodies Johnson & Johnson Clinical Diagnostics, Inc. (US) 1995-12-06 EP disclosed
US-5298403-A Having hydantoin or barbiturate nucleus EASTMAN KODAK COMPANY (US) 1994-03-29 US disclosed
US-5284948-A Drug hapten analogues for immunoassays EASTMAN KODAK COMPANY (US) 1994-02-08 US disclosed
EP-0517326-A2 Labeled drug hapten analogues for immunoassays Johnson & Johnson Clinical Diagnostics, Inc. (US) 1992-12-09 EP disclosed