SCHEMBL11045206

SCHEMBL11045206

CCOC(=O)C1=NN(c2ccc(C(=O)O)cc2)C(=O)C1=Cc1ccc(O)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.66
KMT2A Q03164 7/20 0.66
ALDH1A1 P00352 6/20 0.66
MAPT P10636 5/20 0.66
TDP1 Q9NUW8 3/20 0.66
HPGD P15428 1/20 0.66
KAT8 Q9H7Z6 5/20 0.56
KDM4E B2RXH2 3/20 0.50
MAPK1 P28482 3/20 0.50
THRB P10828 2/20 0.50
SAE1 Q9UBE0 2/20 0.50
UBA2 Q9UBT2 2/20 0.50
POLB P06746 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
USP2 O75604 1/20 0.50
SIRT5 Q9NXA8 1/20 0.48
APEX1 P27695 1/20 0.47
NTSR1 P30989 1/20 0.47
GALK1 P51570 1/20 0.47
EP300 Q09472 2/20 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
SCHEMBL11045202 1.00 MEN1 (0.66) MEN1KMT2AALDH1A1MAPTTDP1
SCHEMBL6139975 0.89 MEN1 (0.83) MEN1KMT2AALDH1A1MAPTTDP1
SCHEMBL13725310 0.89 MEN1 (0.83) MEN1KMT2AALDH1A1MAPTTDP1
SCHEMBL420802 0.84 KAT8 (0.60) MEN1KMT2AALDH1A1MAPTTDP1
SCHEMBL446710 0.84 KAT8 (0.60) MEN1KMT2AALDH1A1MAPTTDP1
SCHEMBL446711 0.84 KAT8 (0.60) MEN1KMT2AALDH1A1MAPTTDP1
SCHEMBL12589909 0.83 TDP2 (0.65) MEN1KMT2AALDH1A1MAPTTDP1
SCHEMBL443203 0.82 KAT8 (0.81) MEN1KMT2AALDH1A1MAPTTDP1
SCHEMBL420591 0.82 KAT8 (0.81) MEN1KMT2AALDH1A1MAPTTDP1
SCHEMBL8078405 0.82 KAT8 (0.81) MEN1KMT2AALDH1A1MAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0021513-B1 PHOTOGRAPHIC SILVER HALIDE MATERIALS CONTAINING DISPERSED LIGHT-ABSORBING MEROSTYRYL DYES AGFA-GEVAERT N.V. (BE) 1984-03-21 EP disclosed
US-4311787-A Photographic silver halide materials containing dispersed light-absorbing merostyryl dyes AGFA-GEVAERT, N.V. (BE) 1982-01-19 US disclosed
EP-0021513-A1 Photographic silver halide materials containing dispersed light-absorbing merostyryl dyes AGFA-GEVAERT N.V. (BE) 1981-01-07 EP disclosed