SCHEMBL20005920

SCHEMBL20005920

CN[C@@]1(CNC(C)C)C[C@H]1CO

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 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
SCHEMBL15927908 0.73 KMT2A (0.33) KMT2A
SCHEMBL15927898 0.73 KMT2A (0.33) KMT2A
SCHEMBL15928608 0.73 KMT2A (0.35) KMT2A
SCHEMBL15927915 0.72 KMT2A (0.33) KMT2A
SCHEMBL15927909 0.72 KMT2A (0.33) KMT2A
SCHEMBL15927925 0.72 KMT2A (0.33) KMT2A
SCHEMBL15927900 0.72 KMT2A (0.33) KMT2A
SCHEMBL20006360 0.71 SLC18A2 (0.40)
SCHEMBL18756529 0.67
SCHEMBL18876635 0.63 KMT2A (0.33) KMT2A

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
EP-2940019-B1 SUBSTITUTED SPIROPYRIDO[1,2-a]PYRAZINE DERIVATIVE AND MEDICINAL USE THEREOF AS HIV INTEGRASE INHIBITOR JAPAN TOBACCO INC (JP) 2018-03-28 EP disclosed