SCHEMBL4882704

SCHEMBL4882704

C[C@@H]1C[C@H](C)CN(C(=O)c2cc(Br)ccc2NC(=O)CCC(=O)N2CCOC(C)(C)C2)C1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KRAS P01116 1/20 0.39
POLB P06746 2/20 0.39
KDM4E B2RXH2 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPK1 P28482 3/20 0.36
ALDH1A1 P00352 3/20 0.35
KMT2A Q03164 1/20 0.34
NPC1 O15118 1/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 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
SCHEMBL21067812 0.87 ALDH1A1 (0.45) POLBKDM4ETDP1L3MBTL1SMN1; SMN2
SCHEMBL4894751 0.85 POLB (0.43) POLBKDM4ETDP1L3MBTL1SMN1; SMN2
SCHEMBL4896609 0.84 KMT2A (0.47) POLBKDM4ETDP1L3MBTL1SMN1; SMN2
SCHEMBL4882712 0.83 HTT (0.47) POLBKDM4ETDP1L3MBTL1SMN1; SMN2
SCHEMBL14087733 0.82 POLB (0.48) POLBKDM4ETDP1L3MBTL1SMN1; SMN2
SCHEMBL4896082 0.82 POLB (0.43) POLBKDM4ETDP1L3MBTL1SMN1; SMN2
SCHEMBL4884288 0.81 ALDH1A1 (0.41) POLBKDM4ETDP1L3MBTL1SMN1; SMN2
SCHEMBL4882718 0.80 KDM4E (0.55) POLBKDM4ETDP1L3MBTL1SMN1; SMN2
SCHEMBL4893113 0.79 POLB (0.47) POLBKDM4ETDP1L3MBTL1SMN1; SMN2
SCHEMBL14087731 0.79 POLB (0.46) POLBKDM4ETDP1L3MBTL1SMN1; SMN2

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 1 patent. 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

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 KRAS 676/4885POLB 79/4885KDM4E 2519/4885

“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.