SCHEMBL13049087

SCHEMBL13049087

CC(C)(C)OC(=O)NCCCCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)OC(c1ccccc1)(c1ccccc1)c1ccccc1Cl

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 1/20 0.47
▸ TLR1 Q15399 1/20 0.47
▸ KMT2A Q03164 5/20 0.45
▸ MDM2 Q00987 1/20 0.45
▸ NPSR1 Q6W5P4 6/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ MDM4 O15151 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ TDP1 Q9NUW8 4/20 0.43
▸ MAPT P10636 4/20 0.43
▸ PAX8 Q06710 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ ATM Q13315 1/20 0.41
▸ KLK7 P49862 1/20 0.40
▸ KLK5 Q9Y337 1/20 0.40

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
SCHEMBL15893676 0.96 TLR2 (0.45) TLR2TLR1KMT2AMDM2NPSR1
SCHEMBL15896483 0.94 TLR2 (0.43) TLR2TLR1KMT2AMDM2NPSR1
SCHEMBL31624506 0.91 KLK7 (0.48) TLR2TLR1MAPTKLK7KLK5
SCHEMBL8242447 0.91 MDM4 (0.43) TLR2TLR1KMT2AMDM2MDM4
SCHEMBL31624497 0.90 HDAC1 (0.48) TLR2TLR1KMT2AKLK7KLK5
SCHEMBL31624368 0.90 HDAC1 (0.48) TLR2TLR1KMT2AKLK7KLK5
SCHEMBL22199740 0.88 KMT2A (0.48) TLR2TLR1KMT2AMDM2NPSR1
SCHEMBL31624560 0.87 SIRT2 (0.46) TLR2TLR1KLK7KLK5
SCHEMBL27261267 0.87 TLR2 (0.54) TLR2TLR1KMT2AMDM2NPSR1
SCHEMBL30783495 0.87 TLR2 (0.54) TLR2TLR1KMT2AMDM2NPSR1

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
US-20100304273-A1 PROTON CONDUCTING MEMBRANES FOR FUEL CELLS HAVING A PROTON GRADIENT AND METHODS FOR PREPARING SAID MEMBRANES COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2010-12-02 — — US disclosed
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