SCHEMBL4896900

SCHEMBL4896900

CC(=O)NC(C)C(=O)Nc1ccc(I)cc1C(=O)N1C[C@H](C)C[C@H](C)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.41
MAP2K1 Q02750 3/20 0.37
GAA P10253 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PTPRC P08575 1/20 0.36
PTPN2 P17706 1/20 0.36
PTPN1 P18031 1/20 0.36
PTPRA P18433 1/20 0.36
PTPRB P23467 1/20 0.36
PTPRE P23469 1/20 0.36
PTPN6 P29350 1/20 0.36
MAP2K2 P36507 1/20 0.36
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 4/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
PLA2G1B P04054 1/20 0.34
ATG4B Q9Y4P1 1/20 0.34

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
SCHEMBL4894071 0.87 ALDH1A1 (0.46) L3MBTL1GAANPSR1MEN1KMT2A
SCHEMBL4884281 0.87 KDM4E (0.44) L3MBTL1GAANPSR1MEN1KMT2A
SCHEMBL14112904 0.87 L3MBTL1 (0.41) L3MBTL1GAANPSR1MEN1KMT2A
SCHEMBL14102867 0.81 L3MBTL1 (0.36) L3MBTL1MAP2K1GAANPSR1MEN1
SCHEMBL4887425 0.80 L3MBTL1 (0.42) L3MBTL1MAP2K1GAANPSR1MEN1
SCHEMBL4892012 0.74 KDM4E (0.41) L3MBTL1GAANPSR1MEN1KMT2A
SCHEMBL4893007 0.74 KDM4E (0.41) L3MBTL1GAANPSR1MEN1KMT2A
SCHEMBL4893019 0.74 KDM4E (0.41) L3MBTL1GAANPSR1MEN1KMT2A
SCHEMBL4886167 0.72 KDM4E (0.39) L3MBTL1GAANPSR1MEN1KMT2A
SCHEMBL4886934 0.72 ALDH1A1 (0.43) L3MBTL1GAANPSR1MEN1KMT2A

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-20080200512-A1 Hepatitis C virus polymerase inhibitors BLANEY JEFFREY MARK 2008-08-21 US disclosed
US-20080200512-A1 Hepatitis C virus polymerase inhibitors BLANEY JEFFREY MARK 2008-08-21 US disclosed
US-20080200512-A1 Hepatitis C virus polymerase inhibitors BLANEY JEFFREY MARK 2008-08-21 US 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-20080200512-A1 Hepatitis C virus polymerase inhibitors SSU72, POLR2H, POLR2E L3MBTL1 3221/4885MAP2K1 4224/4885GAA 1626/4885

“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.