SCHEMBL6097784

SCHEMBL6097784

COC(=O)c1cc(Cc2c(C)c(OC)c(OC)c(OC)c2OC)ccc1Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 3/20 0.41
HSD17B10 Q99714 2/20 0.41
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
TTR P02766 2/20 0.39
PPARA Q07869 2/20 0.39
RAB9A P51151 1/20 0.39
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
POLB P06746 1/20 0.38
TSPO P30536 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TDP1 Q9NUW8 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
SCHEMBL6095093 0.91 KDM4E (0.47) HPGDLMNAKDM4EHSD17B10ALDH1A1
SCHEMBL6098146 0.91 KDM4E (0.48) HPGDKDM4EALDH1A1TTRPPARA
SCHEMBL5859909 0.86 FOLH1 (0.46) HPGDLMNAALDH1A1MAPTRAB9A
SCHEMBL27581050 0.86 PDE10A (0.41) KDM4EALDH1A1GAAMAPTRAB9A
SCHEMBL6095164 0.83 KDM4E (0.60) LMNAKDM4EALDH1A1POLB
SCHEMBL5859081 0.82 KDM4E (0.47) HPGDKDM4EHSD17B10ALDH1A1GAA
SCHEMBL27596131 0.80 KDM4E (0.46) KDM4ERAB9APOLBMEN1KMT2A
SCHEMBL5859880 0.80 HTR7 (0.42) HPGDLMNAKDM4EHSD17B10ALDH1A1
SCHEMBL5862144 0.80 CA12 (0.48) HPGDLMNAKDM4EHSD17B10ALDH1A1
SCHEMBL5859111 0.80 CA12 (0.48) HPGDLMNAKDM4EHSD17B10ALDH1A1

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-7064124-B2 NF-κB inhibitor containing substituted benzoic acid derivative as active ingredient DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2006-06-20 US claimed
US-7064124-B2 NF-κB inhibitor containing substituted benzoic acid derivative as active ingredient DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2006-06-20 US disclosed
US-20040122244-A1 Nf-kappa b inhibitor containing substituted benzoic acid derivative as active ingredient DAIICHI ASUBIO PHARMA CO., LTD. (JP) 2004-06-24 US disclosed
CN-1460097-A NF-kB inhibitor containing substituted benzoic acid derivative as active ingredient DAIICHI SUNTORY SEIYAKU CO LTD (JP) 2003-12-03 CN disclosed
EP-1314712-A1 NF-KAPPA-B INHIBITOR CONTAINING SUBSTITUTED BENZOIC ACID DERIVATIVE AS ACTIVE INGREDIENT Daiichi Suntory Pharma Co., Ltd. (JP) 2003-05-28 EP 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-20040122244-A1 Nf-kappa b inhibitor containing substituted benzoic acid derivative as active ingredient NFKBIA, NFKB1, IKBKB HPGD 604/4885LMNA 1361/4885KDM4E 1491/4885

“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.