SCHEMBL7428323

SCHEMBL7428323

O=CC1CCCCCCCC(=O)N1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.34
CRBN Q96SW2 2/20 0.33
FKBP5 Q13451 1/20 0.33
BACE1 P56817 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
OR51E2 Q9H255 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
SCHEMBL20445551 1.00 KMT2A (0.34) KMT2ACRBNFKBP5BACE1CA1
SCHEMBL7433757 1.00 KMT2A (0.34) KMT2ACRBNFKBP5BACE1CA1
SCHEMBL20444035 1.00 KMT2A (0.34) KMT2ACRBNFKBP5BACE1CA1
SCHEMBL3071586 0.98 CRBN (0.34) KMT2ACRBNFKBP5CA1CA2
SCHEMBL13438779 0.91
SCHEMBL5991463 0.91
SCHEMBL845596 0.82
SCHEMBL3194607 0.82
SCHEMBL37625 0.82
SCHEMBL28426745 0.82 KMT2A (0.33) KMT2ACRBNFKBP5BACE1CA1

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
EP-0462884-B1 TRH DERIVATIVES, THEIR PREPARATIONS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ADIR ET COMPAGNIE (FR) 1993-06-16 EP disclosed
EP-0462884-A1 TRH derivatives, their preparations and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1991-12-27 EP disclosed