SCHEMBL7801461

SCHEMBL7801461

COc1ccc(C(OCCNC(=O)OCC2c3ccccc3-c3ccccc32)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
MDM2 Q00987 1/20 0.43
SLC6A1 P30531 2/20 0.43
SLC6A11 P48066 1/20 0.43
GAA P10253 1/20 0.41
MDM4 O15151 1/20 0.41
TP53 P04637 1/20 0.41
FABP5 Q01469 1/20 0.41

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
SCHEMBL16218325 0.86 KMT2A (0.52) KMT2AMDM2SLC6A1SLC6A11GAA
SCHEMBL16353568 0.86 KMT2A (0.49) KMT2AMDM2SLC6A1SLC6A11GAA
SCHEMBL20371116 0.85 KMT2A (0.44) KMT2AMDM2GAAMDM4TP53
SCHEMBL4557334 0.85 KMT2A (0.56) KMT2AMDM4TP53FABP5
SCHEMBL13671093 0.85 KMT2A (0.56) KMT2AMDM4TP53FABP5
SCHEMBL8843737 0.85 KMT2A (0.52) KMT2AMDM2MDM4TP53
SCHEMBL13485373 0.85 KMT2A (0.50) KMT2AMDM2SLC6A1SLC6A11MDM4
SCHEMBL21901416 0.84 KMT2A (0.47) KMT2AMDM2GAAMDM4TP53
SCHEMBL3423921 0.84 KMT2A (0.46) KMT2AMDM2MDM4TP53
SCHEMBL889833 0.84 KMT2A (0.46) KMT2AMDM2MDM4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0739898-B1 Phosphonomonoester nucleic acids, methods for their preparation and their use AVENTIS PHARMA GMBH (DE) 2001-09-26 EP disclosed
US-6127346-A FOR THE TREATMENT OF VIRUSES HOECHST AKTIENGESELLSCHAFT (DE) 2000-10-03 US disclosed
US-5874553-A ANTIBODIES; INHIBITOR OF GENE EXPRESSION HOECHST AKTIENGESELLSCHAFT (DE) 1999-02-23 US disclosed
EP-0739898-A2 Phosphonomonoester nucleic acids, methods for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1996-10-30 EP disclosed