SCHEMBL10000757

SCHEMBL10000757

CNC(=O)Cc1c(C)c(O)c(CO)c(CO)c1O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.32
ERBB2 P04626 1/20 0.31
PIM1 P11309 1/20 0.31
HKDC1 Q2TB90 1/20 0.31

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
SCHEMBL10000755 0.80 CA1 (0.31)
SCHEMBL10000754 0.79 AKR1B1 (0.36) FASNERBB2PIM1HKDC1
SCHEMBL10000756 0.78 PTGS2 (0.37)
SCHEMBL12744505 0.70 ERBB2 (0.40) FASNERBB2PIM1HKDC1
SCHEMBL16597206 0.67 ERBB2 (0.39) ERBB2PIM1HKDC1
SCHEMBL8573722 0.64 PGK1 (0.37)
SCHEMBL3090283 0.64 ERBB2 (0.48) ERBB2PIM1HKDC1
SCHEMBL14067035 0.64 ERBB2 (0.36) ERBB2PIM1HKDC1
SCHEMBL31606947 0.64 IGF1R (0.36) ERBB2PIM1HKDC1
SCHEMBL723703 0.63 AKR1B1 (0.40) FASN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8207229-B1 Preparation of hydroquinone amide compounds with antioxidant properties CATALYS SAS (FR) 2012-06-26 US disclosed
US-8003824-B2 Preparation of hydroquinone amide compounds with antioxidant properties CATALYS SAS (FR) 2011-08-23 US disclosed
US-20110021820-A1 Preparation of Hydroquinone Amide Compounds with Antioxidant Properties CATALYS SAS (FR) 2011-01-27 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-20110021820-A1 Preparation of Hydroquinone Amide Compounds with Antioxidant Properties NQO1, TYR, AHR FASN 186/4885ERBB2 2837/4885PIM1 4108/4885

“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.