SCHEMBL7914853

SCHEMBL7914853

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

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL7738888 0.76 BTK (0.31)
SCHEMBL7911537 0.73 THRB (0.33) THRBMEN1KMT2A
SCHEMBL5665104 0.71
SCHEMBL5663141 0.71 ADH1A (0.32)
SCHEMBL29255739 0.67
SCHEMBL9269256 0.67
SCHEMBL8131778 0.67
SCHEMBL6659786 0.65 THRB (0.41) THRBMEN1KMT2A
SCHEMBL17507932 0.64 HSD11B1 (0.35)
SCHEMBL5903172 0.64 HSD11B1 (0.35)

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 2 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