SCHEMBL5880823

SCHEMBL5880823

Cc1noc(C)c1COc1ccc(CCC2(C3CCCC3)CC(O)=CC(=O)O2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
GAA P10253 3/20 0.44
HPGD P15428 2/20 0.43
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 2/20 0.42
TDP1 Q9NUW8 1/20 0.40
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
USP2 O75604 1/20 0.38
MAPK1 P28482 1/20 0.38
RORC P51449 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL3991198 0.94 LMNA (0.46) LMNASMN1; SMN2GAAHPGDALDH1A1
SCHEMBL5880846 0.84 MAPT (0.46) LMNASMN1; SMN2MAPT
SCHEMBL5880929 0.80 SMN1; SMN2 (0.33) LMNASMN1; SMN2GAAALDH1A1MAPT
SCHEMBL5881125 0.79 S1PR1 (0.40) SMN1; SMN2
SCHEMBL8340435 0.79 SMN1; SMN2 (0.35) LMNASMN1; SMN2GAAALDH1A1MAPT
SCHEMBL5880743 0.79 SMN1; SMN2 (0.35) LMNASMN1; SMN2GAAALDH1A1MAPT
SCHEMBL5880919 0.78 MRGPRX4 (0.34)
SCHEMBL5881129 0.77 FFAR1 (0.38) ALDH1A1KDM4E
SCHEMBL5880916 0.77 RAB9A (0.45) SMN1; SMN2KDM4ETDP1L3MBTL1
SCHEMBL3988217 0.76 LMNA (0.40) LMNASMN1; SMN2GAAHPGDALDH1A1

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.