SCHEMBL6775193

SCHEMBL6775193

COc1ccc(-c2ccc(S(=O)(=O)NC(CC(O)CSc3nc4ccc(OC)cc4[nH]3)C(=O)O)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.50
CYP2E1 P05181 6/20 0.50
CYP2C8 P10632 6/20 0.50
CYP2D6 P10635 6/20 0.50
CYP2C9 P11712 6/20 0.50
CYP2B6 P20813 6/20 0.50
CYP2C19 P33261 6/20 0.50
CYP3A4 P08684 5/20 0.50
MAPT P10636 3/20 0.49
FPR1 P21462 1/20 0.49
FPR2 P25090 1/20 0.49
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
PRMT5 O14744 1/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
WDR77 Q9BQA1 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MMP2 P08253 4/20 0.47
MMP1 P03956 3/20 0.47

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
SCHEMBL6775181 0.93 MMP2 (0.47) CYP1A2CYP2E1CYP2C8CYP2D6CYP2C9
SCHEMBL6775390 0.92 MMP2 (0.52) MAPTMMP2MMP1MMP3MMP13
SCHEMBL6775910 0.85 MMP2 (0.51) MMP2MMP1MMP3MMP13NPC1
SCHEMBL6780751 0.83 MMP2 (0.49) MMP2MMP1MMP3MMP13MMP9
SCHEMBL6767954 0.81 MMP2 (0.57) MMP2MMP1MMP3MMP13MMP9
SCHEMBL6768133 0.81 MMP2 (0.51) MMP2MMP1MMP3MMP13MMP9
SCHEMBL7498767 0.81 MMP2 (0.51) MMP2MMP1MMP3MMP13MMP9
SCHEMBL6892928 0.80 PPARA (0.48) CYP2C9HPGDMMP2MMP1MMP3
SCHEMBL6774032 0.79 MMP2 (0.58) MMP2MMP1MMP3MMP13MMP9
SCHEMBL6773472 0.79 MMP2 (0.53) MMP2MMP1MMP3MMP13MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030225074-A1 Dihetero-substituted metalloprotease inhibitors THE PROCTER & GAMBLE COMPANY 2003-12-04 US claimed
US-6566381-B1 For therapy of arthritis, cancer, cardiovascular disorder, skin disorder, ocular disorder, inflammation and gum disease THE PROCTER & GAMBLE COMPANY 2003-05-20 US claimed
JP-2002538146-A 2002-11-12 JP claimed
EP-1165530-A2 DIHETERO-SUBSTITUTED METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2002-01-02 EP claimed
WO-2000051993-A2 DIHETERO-SUBSTITUTED METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2000-09-08 WO claimed
US-6762198-B2 SUCH AS 2-((4'-METHOXY-(1,1'-BIPHENYL)-4-YL)-SULFONYL)-AMINO-3-(2-PHENOXYMETHYL -(1,3)DIOXAN-2-YL)PROPIONIC ACID THE PROCTER & GAMBLE COMPANY 2004-07-13 US disclosed
US-20030225074-A1 Dihetero-substituted metalloprotease inhibitors THE PROCTER & GAMBLE COMPANY 2003-12-04 US disclosed
US-6566381-B1 For therapy of arthritis, cancer, cardiovascular disorder, skin disorder, ocular disorder, inflammation and gum disease THE PROCTER & GAMBLE COMPANY 2003-05-20 US disclosed
EP-1165530-A2 DIHETERO-SUBSTITUTED METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2002-01-02 EP disclosed
WO-2000051993-A2 DIHETERO-SUBSTITUTED METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2000-09-08 WO 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-20030225074-A1 Dihetero-substituted metalloprotease inhibitors ADAM9, ADAM17, ADAM8 CYP1A2 379/4885CYP2E1 454/4885CYP2C8 681/4885

“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.