SCHEMBL5880832

SCHEMBL5880832

Cc1noc(C)c1COc1ccc(CCC(=O)C2CCCC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
GAA P10253 3/20 0.56
ALDH1A1 P00352 3/20 0.53
HPGD P15428 1/20 0.52
KDM4E B2RXH2 1/20 0.51
TDP1 Q9NUW8 1/20 0.48
USP2 O75604 1/20 0.46
MAPK1 P28482 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
JAK2 O60674 1/20 0.46
FFAR2 O15552 1/20 0.46

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
SCHEMBL5880872 0.80 SMN1; SMN2 (0.56) LMNASMN1; SMN2
SCHEMBL3986215 0.79 HCAR2 (0.53) LMNA
SCHEMBL3988138 0.75 FFAR1 (0.65) SMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL3499932 0.75 GAA (0.71) LMNASMN1; SMN2GAAALDH1A1TDP1
SCHEMBL1928504 0.75 GAA (0.67) LMNASMN1; SMN2GAAALDH1A1TDP1
SCHEMBL5881486 0.74 GAA (0.66) LMNASMN1; SMN2GAAALDH1A1KDM4E
SCHEMBL8008459 0.74 FFAR1 (0.63) SMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL15012218 0.73 LMNA (0.65) LMNASMN1; SMN2GAAALDH1A1TDP1
SCHEMBL16771569 0.72 GAA (0.80) LMNASMN1; SMN2GAAALDH1A1HPGD
SCHEMBL20511052 0.72 GAA (1.00) LMNASMN1; SMN2GAAALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7115658-B2 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase AGOURON PHARMACEUTICALS, INC. (US) 2006-10-03 US disclosed
US-20040023958-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same AGOURON PHARMACEUTICALS, INC. 2004-02-05 US disclosed
WO-2003095441-A1 INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME PFIZER INC. (US) 2003-11-20 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-20040023958-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same POLRMT, RNGTT, RNASE1 LMNA 3489/4885SMN1; SMN2 3990/4885GAA 977/4885

“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.