SCHEMBL28016994

SCHEMBL28016994

COP(=S)(OC)OCCN

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL28089409 0.75
SCHEMBL13020545 0.70 MEN1 (0.37) MEN1KMT2ATDP1
SCHEMBL117709 0.70 MEN1 (0.42) MEN1KMT2ATDP1
SCHEMBL6735800 0.70 MEN1 (0.42) MEN1KMT2ATDP1
SCHEMBL10790063 0.69
SCHEMBL14368215 0.68
SCHEMBL2773549 0.68 CYP3A4 (0.39)
SCHEMBL118720 0.67 MEN1 (0.70) MEN1KMT2ATDP1
SCHEMBL6739006 0.67 MEN1 (0.70) MEN1KMT2ATDP1
SCHEMBL23683730 0.67

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
CN-104661664-A Chiral control WAVE LIFE SCIENCES PTY LTD 2015-05-27 CN disclosed