SCHEMBL31048296

SCHEMBL31048296

[2H]C([2H])(O)[C@H](CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)NC(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.45
PPARA Q07869 5/20 0.42
PPARG P37231 4/20 0.41
CTSK P43235 7/20 0.41
CTSS P25774 6/20 0.41
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
SYK P43405 1/20 0.40
ACE P12821 1/20 0.39
PPARD Q03181 2/20 0.39
APP P05067 1/20 0.38

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
SCHEMBL5220048 0.91 ATM (0.45) ATMPPARAPPARGCTSKCTSS
SCHEMBL31232348 0.91 ATM (0.45) ATMPPARAPPARGCTSKCTSS
SCHEMBL7842461 0.91 ATM (0.46) ATMPPARAPPARGCTSKCTSS
SCHEMBL5548155 0.91 ATM (0.46) ATMPPARAPPARGCTSKCTSS
SCHEMBL30133471 0.91 ATM (0.46) ATMPPARAPPARGCTSKCTSS
SCHEMBL30096598 0.89 ATM (0.43) ATMPPARAPPARGCTSKCTSS
SCHEMBL28535602 0.89 ATM (0.43) ATMPPARAPPARGCTSKCTSS
SCHEMBL15434331 0.88 ATM (0.42) ATMPPARAPPARGCTSKCTSS
SCHEMBL5221709 0.87 ATM (0.44) ATMPPARAPPARGCTSKCTSS
SCHEMBL29071904 0.87 ATM (0.44) ATMPPARAPPARGCTSKCTSS

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
WO-2024178304-A1 KRAS MODULATORS ALTEROME THERAPEUTICS, INC. (US) 2024-08-29 WO disclosed