SCHEMBL3134049

SCHEMBL3134049

CCOC(=O)c1sc(C(C)C)c(C#N)c1I

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APOBEC3G Q9HC16 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.48
RXFP1 Q9HBX9 1/20 0.47
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
KDM4E B2RXH2 1/20 0.46
FNTA P49354 11/20 0.46
FNTB P49356 11/20 0.46
BRAF P15056 3/20 0.44
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL3139470 0.87 L3MBTL1 (0.53) APOBEC3GL3MBTL1RXFP1ALDH1A1HPGD
SCHEMBL623720 0.82 L3MBTL1 (0.52) APOBEC3GL3MBTL1RXFP1ALDH1A1HPGD
SCHEMBL3131470 0.82 L3MBTL1 (0.52) APOBEC3GL3MBTL1RXFP1ALDH1A1HPGD
SCHEMBL3138034 0.81 FNTA (0.59) APOBEC3GALDH1A1HPGDKDM4EFNTA
SCHEMBL622624 0.79 L3MBTL1 (0.68) APOBEC3GL3MBTL1RXFP1ALDH1A1HPGD
SCHEMBL8281785 0.79 MAPT (0.45) L3MBTL1ALDH1A1HPGDKDM4EMEN1
SCHEMBL3128688 0.79 L3MBTL1 (0.50) APOBEC3GL3MBTL1RXFP1ALDH1A1HPGD
SCHEMBL623756 0.79 L3MBTL1 (0.47) APOBEC3GL3MBTL1RXFP1ALDH1A1HPGD
SCHEMBL3139516 0.78 L3MBTL1 (0.49) APOBEC3GL3MBTL1RXFP1ALDH1A1HPGD
SCHEMBL622911 0.77 KDM4E (0.49) APOBEC3GL3MBTL1RXFP1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7642361-B2 Thiophene and furan compounds ELI LILLY AND COMPANY (US) 2010-01-05 US disclosed
US-7642361-B2 Thiophene and furan compounds ELI LILLY AND COMPANY (US) 2010-01-05 US disclosed
US-7642361-B2 Thiophene and furan compounds ELI LILLY AND COMPANY (US) 2010-01-05 US disclosed
US-20070105852-A1 Thiophene and furan compounds ELI LILLY AND COMPANY 2007-05-10 US disclosed
US-20070105852-A1 Thiophene and furan compounds ELI LILLY AND COMPANY 2007-05-10 US disclosed
US-20070105852-A1 Thiophene and furan compounds ELI LILLY AND COMPANY 2007-05-10 US disclosed
EP-1706395-A1 THIOPHENE AND FURAN COMPOUNDS ELI LILLY AND COMPANY (US) 2006-10-04 EP disclosed
WO-2005070916-A1 THIOPHENE AND FURAN COMPOUNDS ELI LILLY AND COMPANY (US) 2005-08-04 WO disclosed
WO-2005070916-A1 THIOPHENE AND FURAN COMPOUNDS ELI LILLY AND COMPANY (US) 2005-08-04 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-20070105852-A1 Thiophene and furan compounds PSEN2, PSEN1, TPMT APOBEC3G 4286/4885L3MBTL1 3910/4885RXFP1 4836/4885

“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.