SCHEMBL12005115

SCHEMBL12005115

COc1cc(-c2ccc(C(C)(c3ccc(O)cc3)c3cc(C)c(O)c(C)c3)cc2)ccc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.46
FYN P06241 2/20 0.45
RAF1 P04049 2/20 0.43
BRAF P15056 2/20 0.43
ERN1 O75460 1/20 0.42
ESR1 P03372 4/20 0.41
ESR2 Q92731 4/20 0.41
GAA P10253 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
ALOX15 P16050 2/20 0.40
MAPK1 P28482 2/20 0.40
KMT2A Q03164 2/20 0.40
HSD17B10 Q99714 2/20 0.40
ALOX12 P18054 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 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
SCHEMBL12004221 0.96 FYN (0.48) MAOBFYNRAF1BRAFESR1
SCHEMBL12004978 0.92 MAOB (0.55) MAOBRAF1BRAFERN1ESR1
SCHEMBL12005255 0.90 ESR1 (0.53) MAOBFYNRAF1BRAFERN1
SCHEMBL12004567 0.86 ESR1 (0.57) MAOBFYNRAF1BRAFESR1
SCHEMBL12004654 0.86 MAOB (0.55) MAOBRAF1BRAFERN1ESR1
SCHEMBL12006459 0.84 ESR1 (0.53) ESR1ESR2MEN1LMNAHPGD
SCHEMBL12004409 0.83 ESR1 (0.60) ESR1ESR2MEN1LMNAHPGD
SCHEMBL13609946 0.81 MAOB (0.60) MAOBESR1ESR2MEN1HPGD
SCHEMBL9622952 0.81 MAOB (0.69) MAOBRAF1BRAFERN1ESR1
SCHEMBL3813200 0.81 MAOB (0.69) MAOBRAF1BRAFERN1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8816135-B2 Trisphenol compound HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2014-08-26 US disclosed
US-20120220805-A1 NOVEL TRISPHENOL COMPUND HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2012-08-30 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-20120220805-A1 NOVEL TRISPHENOL COMPUND NCOR1, NCOR2, NCOA1 MAOB 3970/4885FYN 4853/4885RAF1 2050/4885

“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.