SCHEMBL6093329

SCHEMBL6093329

COc1ccc(C2=Cc3ccc(OC(C)=O)c(OC(C)=O)c3OC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.45
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPT P10636 5/20 0.39
KDM4E B2RXH2 4/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
ADORA3 P0DMS8 1/20 0.38
PREP P48147 1/20 0.38
TUBB4A P04350 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 1/20 0.38
TUBA1B P68363 1/20 0.38
TUBA4A P68366 1/20 0.38
TUBB4B P68371 1/20 0.38
TUBB3 Q13509 1/20 0.38

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
SCHEMBL2069109 0.93 ADORA3 (0.45) BACE1MAPTKDM4EPOLBADORA3
SCHEMBL2069120 0.88 BACE1 (0.45) BACE1MEN1KMT2AMAPTKDM4E
SCHEMBL2069364 0.81 GBA1 (0.39) BACE1KMT2AKDM4ERAB9APOLB
SCHEMBL4294732 0.80 ADORA3 (0.37) BACE1MAPTKDM4ERAB9APOLB
SCHEMBL16092805 0.80 BACE1 (0.51) BACE1MEN1KMT2AMAPTKDM4E
SCHEMBL2069736 0.78 ALOX5 (0.51) BACE1MEN1KMT2AMAPTKDM4E
SCHEMBL2069685 0.76 RARA (0.42) MEN1KMT2AALDH1A1PTGS2RARA
SCHEMBL4295886 0.76 RARA (0.42) MEN1KMT2AKDM4ENPC1RAB9A
SCHEMBL4287462 0.75 GBA1 (0.38) BACE1MEN1KMT2AMAPTKDM4E
SCHEMBL616913 0.74 ALOX15 (0.46) BACE1MEN1KMT2AMAPTNPC1

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-20060217564-A1 Production of isoflavone derivatives NOVOGEN RESEARCH PTY LTD. 2006-09-28 US claimed

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-20060217564-A1 Production of isoflavone derivatives CYP51A1, EGLN2, EGLN3 BACE1 2962/4885MEN1 1170/4885KMT2A 2984/4885

“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.