SCHEMBL9410028

SCHEMBL9410028

CON(C)[C@H](C(=O)NC(=O)OC(C)(C)C)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CA7 P43166 3/20 0.38
CTSK P43235 5/20 0.36
CTSS P25774 4/20 0.36
CA12 O43570 3/20 0.36
CA14 Q9ULX7 3/20 0.36
CYP2D6 P10635 1/20 0.35
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
DGAT1 O75907 1/20 0.32
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
APLNR P35414 1/20 0.30
CA4 P22748 1/20 0.30
CA9 Q16790 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
SCHEMBL15254162 1.00 CA1 (0.38) CA1CA2CA7CTSKCTSS
SCHEMBL14778520 0.85 CA1 (0.41) CA1CA2CA7CTSKCTSS
SCHEMBL14779061 0.85 CA1 (0.41) CA1CA2CA7CTSKCTSS
SCHEMBL835634 0.83 CA12 (0.37) CA1CA2CA7CTSKCTSS
SCHEMBL14780357 0.77 CA12 (0.36) CA1CA2CA7CTSKCTSS
SCHEMBL7401688 0.77 CTSL (0.41) CA1CA2CA7CTSKCTSS
SCHEMBL14780296 0.77 CA1 (0.37) CA1CA2CA7CTSKCTSS
SCHEMBL2732000 0.76 TDP1 (0.35) CA1CA2CA7CTSKCTSS
SCHEMBL14778691 0.74 CA1 (0.40) CA1CA2CA7CTSKCTSS
SCHEMBL14779117 0.73 CTSK (0.45) CA1CA2CA7CTSKCTSS

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-0618221-A2 Heterocyclic inhibitors of farnesyl protein transferase BRISTOL-MYERS SQUIBB COMPANY (US) 1994-10-05 EP disclosed