SCHEMBL334299

SCHEMBL334299

CC(=O)c1ccc(OCC(=O)N(C)C)cc1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.59
GAA P10253 1/20 0.58
KEAP1 Q14145 5/20 0.55
NFE2L2 Q16236 5/20 0.55
MAPT P10636 4/20 0.54
LMNA P02545 2/20 0.54
POLB P06746 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
HPGD P15428 2/20 0.52
RAB9A P51151 1/20 0.52
MAOB P27338 3/20 0.51
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.49
TP53 P04637 1/20 0.49
HSD17B10 Q99714 1/20 0.49
SRD5A2 P31213 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
SCHEMBL6538720 0.86 SMN1; SMN2 (0.68) SMN1; SMN2KEAP1NFE2L2TP53SRD5A2
SCHEMBL186922 0.83 MAPT (0.64) SMN1; SMN2GAAKEAP1NFE2L2MAPT
SCHEMBL334579 0.83 RAB9A (0.65) SMN1; SMN2L3MBTL1GAAMAPTLMNA
SCHEMBL1958617 0.81 SMN1; SMN2 (0.67) SMN1; SMN2KEAP1NFE2L2HPGDRAB9A
SCHEMBL14220752 0.81 SMN1; SMN2 (0.67) SMN1; SMN2L3MBTL1GAAMAPTLMNA
SCHEMBL12909782 0.81 L3MBTL1 (0.68) SMN1; SMN2L3MBTL1GAAMAPTLMNA
SCHEMBL9749821 0.80 SMN1; SMN2 (0.65) SMN1; SMN2L3MBTL1KEAP1NFE2L2MAPT
SCHEMBL3845636 0.80 SMN1; SMN2 (0.65) SMN1; SMN2KEAP1NFE2L2POLBHPGD
SCHEMBL8320409 0.80 SMN1; SMN2 (0.65) SMN1; SMN2KEAP1NFE2L2POLBHPGD
SCHEMBL2213142 0.80 SMN1; SMN2 (0.65) SMN1; SMN2KEAP1NFE2L2POLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120189579-A1 SUBSTITUTED PYRROLIDINONE AS INHIBITORS OF HEPATITIS C NS5B POLYMERASE, THE PHARMACEUTICAL COMPOSITION THEREOF AND THEIR THERAPEUTIC USE VIVALIS (FR) 2012-07-26 US disclosed
EP-2451453-A1 SUBSTITUTED PYRROLIDINONE AS INHIBITORS OF HEPATITIS C NS5B POLYMERASE, THE PHARMACEUTICAL COMPOSITION THEREOF AND THEIR THERAPEUTIC USE Vivalis (FR) 2012-05-16 EP disclosed
US-8097708-B2 10a-Azalide compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-17 US disclosed
WO-2011004018-A1 SUBSTITUTED PYRROLIDINONE AS INHIBITORS OF HEPATITIS C NS5B POLYMERASE, THE PHARMACEUTICAL COMPOSITION THEREOF AND THEIR THERAPEUTIC USE VIVALIS (FR) 2011-01-13 WO disclosed
US-20090281292-A1 10a-Azalide Compound MEIJI SEIKA PHARMA CO., LTD. (JP) 2009-11-12 US disclosed
EP-1985620-A1 10a-AZALIDE COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2008-10-29 EP 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-20120189579-A1 SUBSTITUTED PYRROLIDINONE AS INHIBITORS OF HEPATITIS C NS5B POLYMERASE, THE PHARMACEUTICAL COMPOSITION THEREOF AND THEIR THERAPEUTIC USE POLM, POLRMT, POLR2E SMN1; SMN2 2576/4885L3MBTL1 4316/4885GAA 1347/4885
US-20090281292-A1 10a-Azalide Compound IL17A, AZI2, HDAC9 SMN1; SMN2 3120/4885L3MBTL1 2853/4885GAA 551/4885

“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.