SCHEMBL8112640

SCHEMBL8112640

CC(O[Si](C)(C)C(C)(C)C)[C@@H](C=O)NC(=O)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.51
SYK P43405 1/20 0.44
CTSK P43235 3/20 0.44
CTSL P07711 3/20 0.43
CTSS P25774 3/20 0.43
CTSB P07858 2/20 0.43
ITGB3 P05106 2/20 0.43
ITGA2B P08514 2/20 0.43
ELANE P08246 1/20 0.43
PSMB1 P20618 1/20 0.43
PSMB5 P28074 1/20 0.43
PSMB2 P49721 1/20 0.43
CTRB1 P17538 2/20 0.43

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
SCHEMBL6486505 1.00 ATM (0.51) ATMSYKCTSKCTSLCTSS
SCHEMBL17352430 0.84 ATM (0.53) ATMSYKCTSKCTSLCTSS
SCHEMBL23455705 0.84 ATM (0.53) ATMSYKCTSKCTSLCTSS
SCHEMBL23455707 0.84 ATM (0.53) ATMSYKCTSKCTSLCTSS
SCHEMBL6487029 0.84 ATM (0.53) ATMSYKCTSKCTSLCTSS
SCHEMBL23392518 0.83 ATM (0.52) ATMSYKCTSKCTSLCTSS
SCHEMBL17351827 0.83 ATM (0.52) ATMSYKCTSKCTSLCTSS
SCHEMBL15936982 0.83 ATM (0.52) ATMSYKCTSKCTSLCTSS
SCHEMBL25693847 0.82 ATM (0.51) ATMSYKCTSKCTSLCTSS
SCHEMBL4394493 0.80 ATM (0.56) ATMCTSKCTSLCTSSCTSB

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-2008151306-A1 SYNTHESIS OF CYCLODEPSIPEPTIDE COMPOUNDS HAVING ANTINEOPLASTIC AND/OR ANTIMICROBIAL ACTIVITY ARIZONA BOARD OF REGENTS, A BODY CORPORATE OF THE STATE OF ARIZONA, ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2008-12-11 WO disclosed