SCHEMBL3935889

SCHEMBL3935889

COc1ccc(-c2c3c(nc4ccc(O)cc24)-c2ccc(O)cc2OC3)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESRRB O95718 13/20 1.00
ESRRA P11474 13/20 1.00
MAPT P10636 5/20 0.48
MAOB P27338 1/20 0.47
ALOX5 P09917 1/20 0.43
THRB P10828 1/20 0.42

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
SCHEMBL3930778 0.89 ESRRB (1.00) ESRRBESRRAMAPTALOX5
SCHEMBL3936583 0.86 ESRRB (1.00) ESRRBESRRAMAPTTHRB
SCHEMBL3922586 0.83 ESRRB (1.00) ESRRBESRRAMAPT
SCHEMBL3933734 0.83 ESRRB (1.00) ESRRBESRRA
SCHEMBL28125736 0.80 ESRRB (0.67) ESRRBESRRAMAPTALOX5THRB
SCHEMBL3922805 0.79 ESRRB (1.00) ESRRBESRRAMAPTTHRB
SCHEMBL14231578 0.78 ESRRB (0.73) ESRRBESRRA
SCHEMBL3925010 0.78 ESRRB (0.63) ESRRBESRRAMAPT
SCHEMBL14231472 0.77 ESRRB (0.71) ESRRBESRRAMAOBTHRB
SCHEMBL3936467 0.76 ESRRB (1.00) ESRRBESRRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009009417-A2 PHARMACEUTICAL COMPOSITIONS AND METHODS OF PREVENTING, TREATING, OR INHIBITING INFLAMMATORY DISEASES, DISORDERS, OR CONDITIONS OF THE SKIN, AND DISEASES, DISORDERS, OR CONDITIONS ASSOCIATED WITH COLLAGEN DEPLETION WYETH (US) 2009-01-15 WO claimed
US-20090010884-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF PREVENTING, TREATING, OR INHIBITING INFLAMMATORY DISEASES, DISORDERS, OR CONDITIONS OF THE SKIN, AND DISEASES, DISORDERS, OR CONDITIONS ASSOCIATED WITH COLLAGEN DEPLETION WYETH (US) 2009-01-08 US claimed
US-7354927-B2 6H-[1]benzopyrano[4,3-b]quinolines and their use as estrogenic agents WYETH (US) 2008-04-08 US claimed
EP-1789420-A2 6H-[1]BENZOPYRANO[4,3-b]QUINOLINES AND THEIR USE AS ESTROGENIC AGENTS Wyeth, A Corporation of the State of Delaware (US) 2007-05-30 EP claimed
WO-2006029146-A2 6H-[1]BENZOPYRANO[4,3-b]QUINOLINES AND THEIR USE AS ESTROGENIC AGENTS WYETH (US) 2006-03-16 WO claimed
US-20060052410-A1 6H-[1]benzopyrano[4,3-b]quinolines and their use as estrogenic agents WYETH (US) 2006-03-09 US claimed
WO-2009009417-A2 PHARMACEUTICAL COMPOSITIONS AND METHODS OF PREVENTING, TREATING, OR INHIBITING INFLAMMATORY DISEASES, DISORDERS, OR CONDITIONS OF THE SKIN, AND DISEASES, DISORDERS, OR CONDITIONS ASSOCIATED WITH COLLAGEN DEPLETION WYETH (US) 2009-01-15 WO disclosed
US-20090010884-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF PREVENTING, TREATING, OR INHIBITING INFLAMMATORY DISEASES, DISORDERS, OR CONDITIONS OF THE SKIN, AND DISEASES, DISORDERS, OR CONDITIONS ASSOCIATED WITH COLLAGEN DEPLETION WYETH (US) 2009-01-08 US disclosed
US-7354927-B2 6H-[1]benzopyrano[4,3-b]quinolines and their use as estrogenic agents WYETH (US) 2008-04-08 US disclosed
EP-1789420-A2 6H-[1]BENZOPYRANO[4,3-b]QUINOLINES AND THEIR USE AS ESTROGENIC AGENTS Wyeth, A Corporation of the State of Delaware (US) 2007-05-30 EP disclosed
WO-2006029146-A2 6H-[1]BENZOPYRANO[4,3-b]QUINOLINES AND THEIR USE AS ESTROGENIC AGENTS WYETH (US) 2006-03-16 WO disclosed
US-20060052410-A1 6H-[1]benzopyrano[4,3-b]quinolines and their use as estrogenic agents WYETH (US) 2006-03-09 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 (2 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-20090010884-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OF PREVENTING, TREATING, OR INHIBITING INFLAMMATORY DISEASES, DISORDERS, OR CONDITIONS OF THE SKIN, AND DISEASES, DISORDERS, OR CONDITIONS ASSOCIATED WITH COLLAGEN DEPLETION COL2A1, COL1A1, COL14A1 ESRRB 10/4885ESRRA 11/4885MAPT 1621/4885
US-20060052410-A1 6H-[1]benzopyrano[4,3-b]quinolines and their use as estrogenic agents CYP19A1, ESR1, ESR2 ESRRB 10/4885ESRRA 8/4885MAPT 3973/4885

“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.