SCHEMBL27809338

SCHEMBL27809338

COC(=O)C1(N)CC1(C)C#N

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 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
SCHEMBL1434492 0.75 NPSR1 (0.38) MEN1KMT2ALMNA
SCHEMBL13639011 0.74 MEN1 (0.37) MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL1434491 0.74 NPSR1 (0.36) MEN1KMT2ALMNA
SCHEMBL15960827 0.69 MEN1 (0.34) MEN1KMT2ALMNA
SCHEMBL26670523 0.69 NPSR1 (0.34) MEN1KMT2ALMNA
SCHEMBL1435953 0.68 NPSR1 (0.44) MEN1KMT2ALMNA
SCHEMBL1434628 0.68 NPSR1 (0.39) MEN1KMT2ALMNA
Bromide SCHEMBL26670486 0.67 NPSR1 (0.33) MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL1435952 0.67 NPSR1 (0.42) MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL1434627 0.67 NPSR1 (0.38) LMNA

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-101801925-A antiviral compounds GILEAD SCIENCES INC 2010-08-11 CN disclosed