SCHEMBL3857975

SCHEMBL3857975

O=C(O)c1ccccc1C(=O)c1ccco1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.60
KMT2A Q03164 5/20 0.60
MEN1 O00255 3/20 0.60
POLB P06746 1/20 0.60
THRB P10828 1/20 0.60
APEX1 P27695 1/20 0.60
RECQL P46063 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
ALOX15 P16050 2/20 0.54
AKR1C3 P42330 1/20 0.53
PIM1 P11309 1/20 0.53
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
PTPN1 P18031 1/20 0.52
KDM4E B2RXH2 3/20 0.50
MAPT P10636 2/20 0.50
GAA P10253 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
RAB9A P51151 3/20 0.49
LMNA P02545 1/20 0.49

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
SCHEMBL6340252 0.83 KMT2A (0.61) ALDH1A1KMT2AMEN1POLBTHRB
SCHEMBL3953437 0.82 ALDH1A1 (0.73) ALDH1A1KMT2AMEN1POLBTHRB
SCHEMBL156257 0.79 ALDH1A1 (0.58) ALDH1A1KMT2AMEN1POLBTHRB
SCHEMBL11311905 0.79 KMT2A (0.60) ALDH1A1KMT2AMEN1POLBTHRB
SCHEMBL27553288 0.79 ALDH1A1 (0.58) ALDH1A1KMT2AMEN1POLBTHRB
Zinc Ion SCHEMBL9364014 0.79 ALDH1A1 (0.53) ALDH1A1KMT2AMEN1POLBTHRB
SCHEMBL11697583 0.79 ALDH1A1 (0.54) ALDH1A1KMT2AALOX15CES2CES1
SCHEMBL181841 0.79 ALDH1A1 (0.74) ALDH1A1KMT2AMEN1POLBTHRB
SCHEMBL8437671 0.78 ALDH1A1 (0.68) ALDH1A1KMT2AMEN1POLBTHRB
SCHEMBL29029980 0.77 KMT2A (0.85) ALDH1A1KMT2AMEN1POLBTHRB

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-7592467-B2 Inhibitors of prolyl endopeptidase PROBIODRUG AG (DE) 2009-09-22 US disclosed
US-20060229357-A1 Compounds PROBIODRUG AG 2006-10-12 US disclosed
EP-0534443-B1 3,6-Disubstituted pyridazine derivatives MITSUBISHI CHEM CORP (JP) 1998-12-30 EP disclosed
US-5462941-A 1-(cyclohexylalkylamino)-4-(phenyl, thienyl, or furyl) phthalazines; anti-platelet agglutination agents for treatment or prevention of cerebro- or cardiovascular disorders MITSUBISHI CHEMICAL CORPORATION (JP) 1995-10-31 US disclosed
EP-0575425-B1 USE OF OXAZOLO- 2,3-a]ISOINDOLE AND IMIDAZO 2,1-a]ISOINDOLE DERIVATIVES AS ANTIVIRAL DRUGS, AND NEW OXAZOLO 2,3-a]ISOINDOLE DERIVATIVES BOEHRINGER MANNHEIM GMBH (DE) 1995-10-11 EP disclosed
EP-0569457-B1 USE OF THIAZOLO-[2,3-A]ISOINDOLE DERIVATIVES AS ANTIVIRAL MEDICAMENTS AND NOVEL THIAZOLO- [2,3-A]ISOINDOLE DERIVATIVES BOEHRINGER MANNHEIM GMBH (DE) 1995-06-14 EP disclosed
EP-0575425-A1 USE OF OXAZOLO- 2,3-a]ISOINDOLE AND IMIDAZO 2,1-a]ISOINDOLE DERIVATIVES AS ANTIVIRAL DRUGS, AND NEW OXAZOLO 2,3-a]ISOINDOLE DERIVATIVES. BOEHRINGER MANNHEIM GMBH (DE) 1993-12-29 EP disclosed
EP-0534443-A1 3,6-Disubstituted pyridazine derivatives Mitsubishi Chemical Corporation (JP) 1993-03-31 EP disclosed
WO-1992016207-A1 USE OF OXAZOLO-[2,3-a]ISOINDOLE AND IMIDAZO[2,1-a]ISOINDOLE DERIVATIVES AS ANTIVIRAL DRUGS, AND NEW OXAZOLO[2,3-a]ISOINDOLE DERIVATIVES BOEHRINGER MANNHEIM GMBH (DE) 1992-10-01 WO disclosed
US-3994920-A APPETITE SUPPRESSANT, ANTIDEPRESSANT AMERICAN HOME PRODUCTS CORPORATION (US) 1976-11-30 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 (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-20060229357-A1 Compounds PREP, BACE1, MME ALDH1A1 2334/4885KMT2A 1173/4885MEN1 1337/4885

“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.