SCHEMBL10520141

SCHEMBL10520141

COc1ccc(Nc2ccc3c(c2)Oc2cc(Nc4ccc(OC)cc4)ccc2C32OC(=O)c3ccccc32)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.61
MAPT P10636 6/20 0.60
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
HTT P42858 3/20 0.60
LMNA P02545 3/20 0.60
ALDH1A1 P00352 3/20 0.60
USP2 O75604 1/20 0.60
FTO Q9C0B1 7/20 0.55
TDP1 Q9NUW8 3/20 0.55
HPGD P15428 2/20 0.55
CYP2C19 P33261 2/20 0.55
RECQL P46063 1/20 0.55
BLM P54132 1/20 0.55
SMAD3 P84022 1/20 0.55
PRMT1 Q99873 1/20 0.55
ACE2 Q9BYF1 1/20 0.55
POLB P06746 2/20 0.46
KDM4E B2RXH2 1/20 0.46
NSD2 O96028 1/20 0.46

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
SCHEMBL16609698 0.88 CYP3A4 (0.48) CYP3A4MAPTMEN1KMT2AHTT
SCHEMBL31063932 0.88 CYP3A4 (0.48) CYP3A4MAPTMEN1KMT2AHTT
SCHEMBL17581035 0.88 FTO (0.63) CYP3A4MAPTMEN1KMT2AHTT
SCHEMBL25759008 0.88 CYP3A4 (0.77) CYP3A4MAPTMEN1KMT2AHTT
SCHEMBL25633972 0.87 CYP3A4 (0.54) CYP3A4MAPTMEN1KMT2AHTT
SCHEMBL10518377 0.87 FTO (0.59) CYP3A4MAPTMEN1KMT2AHTT
SCHEMBL29386324 0.86 CYP3A4 (0.74) CYP3A4MAPTMEN1KMT2AHTT
SCHEMBL1930643 0.86 CYP3A4 (0.74) CYP3A4MAPTMEN1KMT2AHTT
SCHEMBL10145623 0.86 CYP3A4 (0.65) CYP3A4MAPTMEN1KMT2AHTT
SCHEMBL13295494 0.85 FTO (0.56) CYP3A4MAPTMEN1KMT2AHTT

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-0174054-B1 HEAT-SENSITIVE ELEMENT FOR USE IN A THERMAL IMAGING METHOD POLAROID CORPORATION (US) 1989-06-28 EP disclosed
US-4826976-A THERMOCHROMISM POLAROID CORPORATION (US) 1989-05-02 US disclosed
US-4602263-A FOR OPTICAL RECORDING MEDIA POLAROID CORPORATION (US) 1986-07-22 US disclosed
EP-0174054-A2 Heat-sensitive element for use in a thermal imaging method POLAROID CORPORATION (US) 1986-03-12 EP disclosed