SCHEMBL7911537

SCHEMBL7911537

CC(C)(C)N(C=O)[C@@H]1CCCC[C@H]1N

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ADH1A P07327 4/20 0.32
ADH1C P00326 3/20 0.32
ADH4 P08319 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
SCHEMBL7914853 0.73 THRB (0.30) THRBMEN1KMT2A
SCHEMBL6659786 0.73 THRB (0.41) THRBMEN1KMT2A
SCHEMBL9462295 0.73 ADH1A (0.48) ADH1AADH1CADH4
SCHEMBL2025297 0.68 THRB (0.32) THRBMEN1KMT2A
SCHEMBL1988735 0.68 THRB (0.32) THRBMEN1KMT2A
SCHEMBL2025294 0.68 THRB (0.32) THRBMEN1KMT2A
SCHEMBL1353461 0.68 THRB (0.32) THRBMEN1KMT2A
SCHEMBL15910655 0.67 THRB (0.31) THRBMEN1KMT2A
SCHEMBL13993046 0.65 THRB (0.47) THRBMEN1KMT2A
SCHEMBL113492 0.65 THRB (0.47) THRBMEN1KMT2A

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
US-6201103-B1 MONOMERS HAVE (2-AMINOETHYL)GLYCINE BACKBONE; POLYMERASE CHAIN REACTION AMPLIFICATIONS; DETECTION OF POINT MUTATIONS; DIAGNOSIS Nielsen, Peter E. (DK) 2001-03-13 US disclosed
US-5977296-A MONOMERS WITH ALIPHATIC CYCLIC STRUCTURE IN THE BACKBONE; FOR INCREASED CONFORMATION RESTRICTION LEADING TO INCREASED BINDING AFFINITY AND SPECIFICITY; FOR DETECTING POINT MUTATIONS, FOR SUPPRESSING WILD TYPE GENES IN AMPLIFICATION NIELSEN, PETER E. (DK) 1999-11-02 US disclosed
WO-1996020212-A2 PEPTIDE NUCLEIC ACID INCORPORATING A CHIRAL BACKBONE BUCHARDT, DORTE (DK) 1996-07-04 WO disclosed