SCHEMBL7640464

SCHEMBL7640464

OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
F2 P00734 1/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
PRSS3 P35030 1/20 0.30

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
SCHEMBL7638924 0.86 LMNA (0.42) LMNATHRBF2PRSS1PRSS2
SCHEMBL6257714 0.85 THRB (0.31) LMNATHRB
SCHEMBL6256217 0.85 THRB (0.31) LMNATHRB
SCHEMBL7638933 0.84 LMNA (0.33) LMNATHRBF2PRSS1PRSS2
SCHEMBL346173 0.83 LMNA (0.44) LMNATHRBF2PRSS1PRSS2
SCHEMBL6236464 0.83 LMNA (0.44) LMNATHRBF2PRSS1PRSS2
SCHEMBL623448 0.83 LMNA (0.44) LMNATHRBF2PRSS1PRSS2
SCHEMBL1800782 0.83 LMNA (0.44) LMNATHRBF2PRSS1PRSS2
SCHEMBL6443127 0.83 LMNA (0.44) LMNATHRBF2PRSS1PRSS2
SCHEMBL50596 0.83 LMNA (0.44) LMNATHRBF2PRSS1PRSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6468502-B1 PARAMAGNETIC MACROMOLECULES WITH HIGHER PROTON RELAXIVITY; LOWER DOSAGE AND INCREASED SIGNAL INTENSITY; DETECTING VASCULAR DISEASES; DIFFERENTIATING TISSUE BLOOD SUPPLY LEVELS; DISTINGUISHING MYOCARDIAL INFARCTION FROM ISCHEMIA SCHERING AKTIENGESELLSCHAFT (DE) 2002-10-22 US disclosed