SCHEMBL8583770

SCHEMBL8583770

CCCCC(NC(=O)CNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 4/20 0.57
▸ MDM2 Q00987 6/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ MDM4 O15151 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ CASP3 P42574 1/20 0.46
▸ TNF P01375 1/20 0.45

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
SCHEMBL29503829 0.89 TLR2 (0.62) TLR2MDM2MDM4TP53CASP3
SCHEMBL30645689 0.89 TLR2 (0.62) TLR2MDM2MDM4TP53CASP3
SCHEMBL29382791 0.89 TLR2 (0.62) TLR2MDM2MDM4TP53CASP3
SCHEMBL29398487 0.89 TLR2 (0.62) TLR2MDM2MDM4TP53CASP3
SCHEMBL1044856 0.89 TLR2 (0.62) TLR2MDM2MDM4TP53CASP3
SCHEMBL7420121 0.89 TLR2 (0.62) TLR2MDM2MDM4TP53CASP3
SCHEMBL1000115 0.89 TLR2 (0.62) TLR2MDM2MDM4TP53CASP3
SCHEMBL29367120 0.89 TLR2 (0.62) TLR2MDM2MDM4TP53CASP3
SCHEMBL23447239 0.89 TLR2 (0.59) TLR2MDM2KMT2AMDM4TP53
SCHEMBL29561038 0.89 TLR2 (0.51) TLR2MDM2KMT2AMDM4TP53

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5854410-A Oligonucleoside cleavage compounds and therapies GENTA INCORPORATED (US) 1998-12-29 — — US disclosed
EP-0542887-B1 PSORALEN CONJUGATED METHYLPHOSPHONATE OLIGONUCLEOTIDES AS THERAPEUTIC AGENTS FOR CHRONIC MYELOGENOUS LEUKEMIA GENTA INC (US) 1998-12-02 — — EP disclosed
EP-0542928-A4 IMPROVED NON-NUCLEOTIDE-BASED LINKER REAGENTS FOR OLIGOMERS GENTA INC (US) 1994-07-27 — — EP disclosed
EP-0542928-A1 IMPROVED NON-NUCLEOTIDE-BASED LINKER REAGENTS FOR OLIGOMERS GENTA INCORPORATED (US) 1993-05-26 — — EP disclosed
EP-0542887-A1 PSORALEN CONJUGATED METHYLPHOSPHONATE OLIGONUCLEOTIDES AS THERAPEUTIC AGENTS FOR CHRONIC MYELOGENOUS LEUKEMIA GENTA INCORPORATED (US) 1993-05-26 — — EP disclosed
WO-1992002641-A1 PSORALEN CONJUGATED METHYLPHOSPHONATE OLIGONUCLEOTIDES AS THERAPEUTIC AGENTS FOR CHRONIC MYELOGENOUS LEUKEMIA GENTA INCORPORATED (US) 1992-02-20 — — WO disclosed
WO-1992002532-A1 IMPROVED NON-NUCLEOTIDE-BASED LINKER REAGENTS FOR OLIGOMERS GENTA INCORPORATED (US) 1992-02-20 — — WO disclosed
Send feedback