SCHEMBL2106757

SCHEMBL2106757

C[C@@H]1CC(=O)c2cc(F)ccc2O1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.67
MAOB P27338 12/20 0.48
ACHE P22303 1/20 0.46
TDP1 Q9NUW8 1/20 0.43
CYP19A1 P11511 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
BRD4 O60885 1/20 0.41
CREBBP Q92793 1/20 0.41

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
SCHEMBL1984847 1.00 PBRM1 (0.67) PBRM1MAOBACHETDP1CYP19A1
SCHEMBL9819050 0.87 MAOB (0.63) PBRM1MAOB
SCHEMBL3681000 0.81 PBRM1 (0.69) PBRM1MAOBACHETDP1CYP19A1
SCHEMBL3683723 0.81 PBRM1 (0.69) PBRM1MAOBACHETDP1CYP19A1
SCHEMBL31015961 0.80 PBRM1 (1.00) PBRM1MAOBTDP1CYP19A1KDM4E
SCHEMBL18013010 0.80 PBRM1 (1.00) PBRM1MAOBTDP1CYP19A1KDM4E
SCHEMBL13335352 0.80 PBRM1 (0.43) PBRM1MAOBACHETDP1BRD4
SCHEMBL10076980 0.80 PBRM1 (0.67) PBRM1MAOBTDP1CYP19A1KDM4E
SCHEMBL68075 0.80 PBRM1 (0.67) PBRM1MAOBTDP1CYP19A1KDM4E
SCHEMBL23788312 0.80 SIRT2 (0.46) PBRM1MAOBCYP19A1KDM4EALDH1A1

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
US-8158667-B2 Topical treatment of cataracts in dogs BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA 2012-04-17 US disclosed
US-8158667-B2 Topical treatment of cataracts in dogs BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA 2012-04-17 US disclosed
US-8158667-B2 Topical treatment of cataracts in dogs BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA 2012-04-17 US disclosed
WO-2010065024-A1 TOPICAL TREATMENT OF CATARACTS IN DOGS KADOR PETER F (US) 2010-06-10 WO disclosed
WO-2010065024-A1 TOPICAL TREATMENT OF CATARACTS IN DOGS KADOR PETER F (US) 2010-06-10 WO disclosed
US-20090082415-A1 Topical treatment of cataracts in dogs BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA 2009-03-26 US disclosed
US-20090082415-A1 Topical treatment of cataracts in dogs BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA 2009-03-26 US disclosed
US-20090082415-A1 Topical treatment of cataracts in dogs BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA 2009-03-26 US disclosed
EP-0230379-B1 CHROMAN- AND THIOCHROMAN-4-ACETIC ACIDS USEFUL IN THE TREATMENT OF DIABETIC COMPLICATIONS PFIZER INC. (US) 1991-04-03 EP disclosed
US-4853410-A Hydroxyacetic acid derivatives for the treatment of diabetic complications PFIZER INC. (US) 1989-08-01 US disclosed
WO-1987004344-A1 HYDROXYACETIC ACID DERIVATIVES FOR THE TREATMENT OF DIABETIC COMPLICATIONS PFIZER INC. (US) 1987-07-30 WO disclosed
EP-0230379-A2 Chroman- and thiochroman-4-acetic acids useful in the treatment of diabetic complications PFIZER INC. (US) 1987-07-29 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-20090082415-A1 Topical treatment of cataracts in dogs AKR1A1, AKR1B1, AKR1C1 PBRM1 1126/4885MAOB 3288/4885ACHE 394/4885

“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.