SCHEMBL12435973

SCHEMBL12435973

COc1cc(OC(=O)c2cc(C)cc(NC(C)=O)c2)cc(OC)c1OC

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.64
MEN1 O00255 4/20 0.64
MAPT P10636 5/20 0.52
KDM4E B2RXH2 1/20 0.47
POLB P06746 3/20 0.45
ALDH1A1 P00352 2/20 0.45
GFER P55789 1/20 0.45
LMNA P02545 2/20 0.44
GLA P06280 1/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
BRAF P15056 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
MAPK1 P28482 1/20 0.40
IDO1 P14902 1/20 0.40
TDO2 P48775 1/20 0.40
ACHE P22303 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
SCHEMBL12435972 0.86 KMT2A (0.52) KMT2AMEN1MAPTKDM4EPOLB
SCHEMBL2217344 0.83 MEN1 (0.49) KMT2AMEN1MAPTKDM4EPOLB
SCHEMBL12435974 0.83 MAPT (0.58) KMT2AMEN1MAPTKDM4EPOLB
SCHEMBL16675170 0.80 KMT2A (0.61) KMT2AMEN1MAPTKDM4EPOLB
SCHEMBL17507537 0.79 KMT2A (0.45) KMT2AMEN1MAPTKDM4EPOLB
SCHEMBL6796229 0.77 MAPT (0.62) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL9970898 0.75 MEN1 (0.81) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL12435914 0.73 KMT2A (0.46) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL16134064 0.71 KMT2A (0.56) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL9410845 0.70 MEN1 (0.45) KMT2AMEN1MAPTKDM4EPOLB

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-20110178108-A1 Group of amino substituted benzoyl derivatives and their preparation and their use Institute of Medicinal Biotechnology Academy of Medical Science (CN) 2011-07-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110178108-A1 Group of amino substituted benzoyl derivatives and their preparation and their use CUL3, APOBEC3G, BRPF3 KMT2A 964/4885MEN1 4747/4885MAPT 3474/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.