SCHEMBL8000480

SCHEMBL8000480

C=CCOc1ccc2c(c1)C(=O)c1ccccc1-2

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
LMNA P02545 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
PTPRC P08575 1/20 0.53
CA12 O43570 3/20 0.47
CA1 P00915 3/20 0.47
CA9 Q16790 3/20 0.47
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
ADORA2A P29274 1/20 0.45
ADRA2A P08913 1/20 0.44
ADRA2B P18089 1/20 0.44
ADRA2C P18825 1/20 0.44
CHRNA7 P36544 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL10658820 0.98 MEN1 (0.54) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL22215903 0.93 MAPT (0.63) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL8428065 0.82 PTPRC (0.58) KMT2AMEN1LMNASMN1; SMN2PTPRC
SCHEMBL7989609 0.81 MEN1 (0.56) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL3434413 0.79 MEN1 (0.54) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL10887519 0.78 MAPT (0.67) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL10347244 0.77 KMT2A (0.88) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL9240977 0.77 MAPT (0.44) MAPTKMT2AMEN1ADORA2ACHRNA7
SCHEMBL9148081 0.77 MAPT (0.55) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL577828 0.76 ADRA2A (0.54) MAPTKMT2AMEN1LMNASMN1; SMN2

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-8372802-B2 Fluorinated macrocyclic compounds as hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2013-02-12 US disclosed
US-8372802-B2 Fluorinated macrocyclic compounds as hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2013-02-12 US disclosed
US-8222203-B2 Macrocyclic oximyl hepatitis C serine protease inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2012-07-17 US disclosed
US-8222203-B2 Macrocyclic oximyl hepatitis C serine protease inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2012-07-17 US disclosed
US-20090238794-A1 FLUORINATED MACROCYCLIC COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2009-09-24 US disclosed
US-20090238794-A1 FLUORINATED MACROCYCLIC COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2009-09-24 US disclosed
WO-2009117594-A1 FLUORINATED MACROCYCLIC COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2009-09-24 WO disclosed
US-20090180984-A1 MACROCYCLIC OXIMYL HEPATITIS C SERINE PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. 2009-07-16 US disclosed
US-20090180984-A1 MACROCYCLIC OXIMYL HEPATITIS C SERINE PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. 2009-07-16 US disclosed
WO-2009079352-A1 MACROCYCLIC OXIMYL HEPATITIS C SERINE PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2009-06-25 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 (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-20090180984-A1 MACROCYCLIC OXIMYL HEPATITIS C SERINE PROTEASE INHIBITORS SPINT2, HPN, PRSS1 MAPT 4520/4885KMT2A 2340/4885MEN1 4233/4885
US-20090238794-A1 FLUORINATED MACROCYCLIC COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS CTSC, SPINT2, CTSV MAPT 4301/4885KMT2A 2790/4885MEN1 3944/4885

“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.