SCHEMBL4893793

SCHEMBL4893793

C[C@@H]1C[C@H](C)CN(C(=O)c2cc(Br)ccc2NC(=O)CCC(=O)N[C@@H](C)c2ccccc2)C1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.44
POLB P06746 4/20 0.44
PRCP P42785 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
KDM4E B2RXH2 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
ATM Q13315 1/20 0.41
MAPT P10636 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL4894266 1.00 MAPK1 (0.44) MAPK1POLBPRCPL3MBTL1KDM4E
SCHEMBL4896120 0.89 POLB (0.51) MAPK1POLBPRCPL3MBTL1ATM
SCHEMBL4882718 0.85 KDM4E (0.55) MAPK1POLBL3MBTL1KDM4ETDP1
SCHEMBL14087733 0.83 POLB (0.48) MAPK1POLBL3MBTL1KDM4ETDP1
SCHEMBL4896562 0.83 LMNA (0.47) MAPK1POLBL3MBTL1KDM4ETDP1
SCHEMBL4893113 0.82 POLB (0.47) MAPK1POLBL3MBTL1KDM4ETDP1
SCHEMBL14087731 0.81 POLB (0.46) MAPK1POLBL3MBTL1KDM4ETDP1
SCHEMBL4894528 0.81 MAPT (0.43) MAPK1POLBL3MBTL1KDM4ETDP1
SCHEMBL4886327 0.81 POLB (0.46) MAPK1POLBL3MBTL1KDM4ETDP1
SCHEMBL4894426 0.80 MAPK1 (0.43) MAPK1POLBKDM4ETDP1MEN1

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 MAPK1 3579/4885POLB 79/4885PRCP 735/4885

“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.