SCHEMBL12419956

SCHEMBL12419956

COc1cc(C2(c3cc(C)c(O)c(OC)c3)CCC(C(C)(C)C3CCC(c4cc(C)c(O)c(C=O)c4)(c4cc(C)c(O)c(C=O)c4)CC3)CC2)cc(C)c1O

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 17/20 0.42
ACHE P22303 1/20 0.36
PIK3CA P42336 1/20 0.35
PIK3CG P48736 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL13559715 1.00 ERN1 (0.42) ERN1ACHEPIK3CAPIK3CGLMNA
SCHEMBL2190913 0.91 ACHE (0.43) ERN1ACHE
SCHEMBL13559928 0.81 ACHE (0.37) ACHE
SCHEMBL13518943 0.78 ACHE (0.47) ERN1ACHELMNA
SCHEMBL12419961 0.78 ALDH1A1 (0.37)
SCHEMBL28308729 0.78 ACHE (0.58) ACHE
SCHEMBL12419957 0.77 ALDH1A1 (0.41) MAPT
SCHEMBL13519069 0.76 ACHE (0.55) ERN1ACHE
SCHEMBL13518911 0.74 ACHE (0.44) ERN1ACHE
SCHEMBL17435979 0.74 ACHE (0.41) ERN1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9522868-B2 Tetrakis(ether-substituted formylphenyl) HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2016-12-20 US disclosed
US-20160016884-A1 NEW TETRAKIS(ETHER-SUBSTITUTED FORMYLPHENYL) HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2016-01-21 US disclosed
US-8921613-B2 Polynuclear poly(phenol) family HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2014-12-30 US disclosed
US-20120277479-A1 NOVEL POLYNUCLEAR POLY(PHENOL) FAMILY HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2012-11-01 US disclosed
US-20110172457-A1 TETRAKIS(ETHER-SUBSTITUTED FORMYLPHENYL) AND NEW POLYNUCLEAR POLYPHENOL DERIVED FROM THE SAME HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2011-07-14 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 (3 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-20160016884-A1 NEW TETRAKIS(ETHER-SUBSTITUTED FORMYLPHENYL) AHR, PAH, ALK ERN1 2182/4885ACHE 4873/4885PIK3CA 4403/4885
US-20120277479-A1 NOVEL POLYNUCLEAR POLY(PHENOL) FAMILY PAH, C1S, AP1S1 ERN1 2432/4885ACHE 3989/4885PIK3CA 3380/4885
US-20110172457-A1 TETRAKIS(ETHER-SUBSTITUTED FORMYLPHENYL) AND NEW POLYNUCLEAR POLYPHENOL DERIVED FROM THE SAME AHR, PAH, ARNT ERN1 3527/4885ACHE 4301/4885PIK3CA 3214/4885

“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.