SCHEMBL23699285

SCHEMBL23699285

CC(C)(C)OC(=O)NCC(CCc1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.55
CTSS P25774 3/20 0.55
SYK P43405 1/20 0.53
MEN1 O00255 1/20 0.51
GAA P10253 1/20 0.51
KMT2A Q03164 1/20 0.51
ATM Q13315 1/20 0.47
SIGMAR1 Q99720 3/20 0.46
IDO1 P14902 1/20 0.46
CTSL P07711 1/20 0.45
CTSB P07858 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA7 P43166 1/20 0.45
CA14 Q9ULX7 1/20 0.45
PPARA Q07869 2/20 0.44
PPARG P37231 1/20 0.44
PRSS1 P07477 1/20 0.44
CTSG P08311 1/20 0.44
CTRB1 P17538 1/20 0.44

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
SCHEMBL23699373 0.90 SYK (0.54) CTSKCTSSSYKMEN1GAA
SCHEMBL3825012 0.86 ATM (0.55) CTSKCTSSSYKMEN1GAA
SCHEMBL1186455 0.86 ATM (0.55) CTSKCTSSSYKMEN1GAA
SCHEMBL825959 0.86 ATM (0.55) CTSKCTSSSYKMEN1GAA
SCHEMBL8239858 0.85 CTSK (0.56) CTSKCTSSSYKATMSIGMAR1
SCHEMBL18085403 0.85 CTSK (0.54) CTSKCTSSSYKMEN1KMT2A
SCHEMBL2548413 0.84 CTSK (0.58) CTSKCTSSSYKATMSIGMAR1
SCHEMBL2548417 0.84 CTSK (0.58) CTSKCTSSSYKATMSIGMAR1
SCHEMBL1627707 0.80 SYK (0.67) CTSKCTSSSYKMEN1KMT2A
SCHEMBL31757814 0.79 MEN1 (0.46) CTSKCTSSSYKMEN1GAA

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-3858439-A1 AMIDE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2021-08-04 EP disclosed
CN-106029672-A Serine/threonine kinase inhibitors 基因泰克公司 2016-10-12 CN disclosed