SCHEMBL4928599

SCHEMBL4928599

COC(=O)/C(=C/c1cc(OC)cc(OC)c1)c1ccc(Oc2ccc(CO)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.65
NQO2 P16083 6/20 0.48
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
MMP13 P45452 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
PTGS1 P23219 1/20 0.40
FFAR1 O14842 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39

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
SCHEMBL3794641 1.00 PPARG (0.65) PPARGNQO2MAPTLMNAMMP13
SCHEMBL12632941 0.90 PPARG (0.57) PPARGMAPTMEN1ALDH1A1KMT2A
SCHEMBL3793581 0.89 PPARG (0.64) PPARGNQO2MAPTLMNAMMP13
SCHEMBL3793587 0.89 PPARG (0.64) PPARGNQO2MAPTLMNAMMP13
SCHEMBL13372018 0.89 PPARG (0.64) PPARGNQO2MAPTLMNAMMP13
SCHEMBL4654616 0.85 PPARG (0.60) PPARGNQO2MAPTLMNAFFAR1
SCHEMBL4654618 0.85 PPARG (0.60) PPARGNQO2MAPTLMNAFFAR1
SCHEMBL14087880 0.85 PPARG (0.60) PPARGNQO2MAPTLMNAFFAR1
SCHEMBL3797579 0.85 PPARG (0.59) PPARGNQO2MAPTLMNAMEN1
SCHEMBL3793593 0.85 PPARG (0.59) PPARGNQO2MAPTLMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7718682-B2 Heterocyclic analogs of diphenylethylene compounds THERACOS, INC. (US) 2010-05-18 US disclosed
US-20080293949-A1 Novel heterocyclic analogs of diphenylethylene compounds THERACOS, INC. (US) 2008-11-27 US disclosed
US-20080293949-A1 Novel heterocyclic analogs of diphenylethylene compounds THERACOS, INC. (US) 2008-11-27 US disclosed
US-20080188654-A1 Compounds for treatment of inflammation, diabetes and related disorders THERACOS, INC. (US) 2008-08-07 US disclosed
US-20080188654-A1 Compounds for treatment of inflammation, diabetes and related disorders THERACOS, INC. (US) 2008-08-07 US disclosed
US-20080188654-A1 Compounds for treatment of inflammation, diabetes and related disorders THERACOS, INC. (US) 2008-08-07 US disclosed
US-7407978-B2 Heterocyclic analogs of diphenylethylene compounds THERACOS, INC. (US) 2008-08-05 US disclosed
US-20080108825-A1 Compounds for treatment of inflammation, diabetes and related disorders THERACOS, INC. (US) 2008-05-08 US disclosed
US-20080108825-A1 Compounds for treatment of inflammation, diabetes and related disorders THERACOS, INC. (US) 2008-05-08 US disclosed
US-20080103302-A1 Compounds for treatment of inflammation, diabetes and related disorders THERACOS, INC. (US) 2008-05-01 US disclosed
US-20080103302-A1 Compounds for treatment of inflammation, diabetes and related disorders THERACOS, INC. (US) 2008-05-01 US disclosed
US-20080103302-A1 Compounds for treatment of inflammation, diabetes and related disorders THERACOS, INC. (US) 2008-05-01 US disclosed
US-7323496-B2 Compounds for treatment of inflammation, diabetes and related disorders THERACOS, INC. (US) 2008-01-29 US disclosed
US-7323496-B2 Compounds for treatment of inflammation, diabetes and related disorders THERACOS, INC. (US) 2008-01-29 US disclosed
US-7323496-B2 Compounds for treatment of inflammation, diabetes and related disorders THERACOS, INC. (US) 2008-01-29 US disclosed
US-20070259961-A9 COMPOUNDS FOR TREATMENT OF INFLAMMATION, DIABETES AND RELATED DISORDERS NEOGI PARTHA 2007-11-08 US disclosed
US-20070259961-A9 COMPOUNDS FOR TREATMENT OF INFLAMMATION, DIABETES AND RELATED DISORDERS NEOGI PARTHA 2007-11-08 US disclosed
US-20070259961-A9 COMPOUNDS FOR TREATMENT OF INFLAMMATION, DIABETES AND RELATED DISORDERS NEOGI PARTHA 2007-11-08 US disclosed
US-20040097593-A1 Compounds for treatment of inflammation, diabetes and related disorders SEED, BRIAN 2004-05-20 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 (6 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-20070259961-A9 COMPOUNDS FOR TREATMENT OF INFLAMMATION, DIABETES AND RELATED DISORDERS CPS1, ABAT, IL6 PPARG 106/4885NQO2 2306/4885MAPT 3945/4885
US-20080103302-A1 Compounds for treatment of inflammation, diabetes and related disorders CPS1, ABAT, IL6 PPARG 99/4885NQO2 2286/4885MAPT 3929/4885
US-20080108825-A1 Compounds for treatment of inflammation, diabetes and related disorders CPS1, ABAT, IL6 PPARG 99/4885NQO2 2286/4885MAPT 3929/4885
US-20040097593-A1 Compounds for treatment of inflammation, diabetes and related disorders CPS1, ABAT, IL6 PPARG 106/4885NQO2 2306/4885MAPT 3945/4885
US-20080293949-A1 Novel heterocyclic analogs of diphenylethylene compounds FFAR2, FFAR4, GPR119 PPARG 10/4885NQO2 1897/4885MAPT 4326/4885
US-20080188654-A1 Compounds for treatment of inflammation, diabetes and related disorders CPS1, ABAT, IL6 PPARG 99/4885NQO2 2286/4885MAPT 3929/4885

“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.