SCHEMBL30302011

SCHEMBL30302011

CON(C)C(=O)c1cc(N(C(=O)O)C(=O)OC(C)(C)C)c(F)c(C(F)(F)F)c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.36
CACNA1G O43497 1/20 0.32
CACNA1B Q00975 1/20 0.32
CACNA1C Q13936 1/20 0.32
BACE1 P56817 3/20 0.32
EPHX2 P34913 1/20 0.31
RORC P51449 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
SCHEMBL23526242 1.00 MLYCD (0.36) MLYCDCACNA1GCACNA1BCACNA1CBACE1
SCHEMBL30014266 0.94 MLYCD (0.38) MLYCDCACNA1GCACNA1BCACNA1CBACE1
SCHEMBL25839091 0.94 MLYCD (0.38) MLYCDCACNA1GCACNA1BCACNA1CBACE1
SCHEMBL30014032 0.84 THRA (0.33) MLYCDCACNA1GCACNA1BCACNA1C
SCHEMBL442484 0.73 LMNA (0.40) EPHX2
SCHEMBL29945782 0.73 MLYCD (0.43) MLYCDEPHX2RORC
SCHEMBL23526088 0.73 MLYCD (0.43) MLYCDEPHX2RORC
SCHEMBL18146720 0.70
SCHEMBL31643114 0.69 MLYCD (0.40) MLYCDEPHX2
SCHEMBL28880360 0.69 MLYCD (0.40) MLYCDEPHX2RORC

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-4358963-A1 SOS1 INHIBITORS Mirati Therapeutics, Inc. (US) 2024-05-01 EP disclosed
WO-2022271679-A1 SOS1 INHIBITORS Mirati Therapeutics, Inc. (US) 2022-12-29 WO disclosed