SCHEMBL7989609

SCHEMBL7989609

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
LMNA P02545 1/20 0.56
MAPT P10636 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
FGFR1 P11362 1/20 0.42
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
CA12 O43570 5/20 0.40
CA1 P00915 5/20 0.40
CA9 Q16790 5/20 0.40
ALDH1A1 P00352 2/20 0.39
PTPRC P08575 1/20 0.39
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
BCHE P06276 1/20 0.37
HPGD P15428 2/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37

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
SCHEMBL8000480 0.81 MAPT (0.56) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL10658820 0.79 MEN1 (0.54) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL10347244 0.77 KMT2A (0.88) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL22215903 0.76 MAPT (0.63) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL577828 0.73 ADRA2A (0.54) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL577827 0.73 MEN1 (0.48) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL3434413 0.72 MEN1 (0.54) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL22700976 0.72 MEN1 (0.47) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL470906 0.72 CA12 (0.57) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL30541768 0.72 CA12 (0.57) MEN1KMT2ALMNAMAPTSMN1; 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 8 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-8283309-B2 Bridged carbocyclic oxime hepatitis C virus serine protease inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2012-10-09 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
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-20090180985-A1 BRIDGED CARBOCYCLIC OXIME HEPATITIS C VIRUS 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 (3 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-20090180985-A1 BRIDGED CARBOCYCLIC OXIME HEPATITIS C VIRUS SERINE PROTEASE INHIBITORS CPN1, CCNE2, CCNE1 MEN1 4595/4885KMT2A 2062/4885LMNA 3013/4885
US-20090180984-A1 MACROCYCLIC OXIMYL HEPATITIS C SERINE PROTEASE INHIBITORS SPINT2, HPN, PRSS1 MEN1 4233/4885KMT2A 2340/4885LMNA 2771/4885
US-20090238794-A1 FLUORINATED MACROCYCLIC COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS CTSC, SPINT2, CTSV MEN1 3944/4885KMT2A 2790/4885LMNA 2453/4885

“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.