SCHEMBL20121274

SCHEMBL20121274

CCC1CCCCCCCCCCCCCCCCCCCCCC1N

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
DPP4 P27487 1/20 0.38
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
SHBG P04278 1/20 0.33
NOS3 P29474 3/20 0.32
NOS1 P29475 3/20 0.32
NOS2 P35228 3/20 0.32
CYP1A2 P05177 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
SCHEMBL27289511 1.00 THRB (0.45) THRBMEN1KMT2ADPP4CA1
SCHEMBL18822565 1.00 THRB (0.45) THRBMEN1KMT2ADPP4CA1
SCHEMBL18822626 1.00 THRB (0.45) THRBMEN1KMT2ADPP4CA1
SCHEMBL20615492 1.00 THRB (0.45) THRBMEN1KMT2ADPP4CA1
SCHEMBL15494282 1.00 THRB (0.45) THRBMEN1KMT2ADPP4CA1
SCHEMBL12514997 1.00 THRB (0.45) THRBMEN1KMT2ADPP4CA1
SCHEMBL13467652 1.00 THRB (0.45) THRBMEN1KMT2ADPP4CA1
SCHEMBL894912 0.97
SCHEMBL895359 0.97
SCHEMBL15314092 0.97

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-9965218-B1 Techniques using multiple service level objectives in connection with a storage group EMC IP Holding Company LLC (US) 2018-05-08 US disclosed