SCHEMBL4908569

SCHEMBL4908569

COc1ccc(NC(=O)CNC(C)=O)c(C(=O)N2C[C@H](C)C[C@H](C)C2)c1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HPGD P15428 2/20 0.44
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 2/20 0.41
CPS1 P31327 5/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL4908582 1.00 ALDH1A1 (0.47) ALDH1A1NPSR1HPGDRAB9AKDM4E
SCHEMBL4898755 0.86 L3MBTL1 (0.42) ALDH1A1NPSR1HPGDKDM4EL3MBTL1
SCHEMBL4886246 0.85 KDM4E (0.44) ALDH1A1NPSR1HPGDKDM4ESMN1; SMN2
SCHEMBL4887425 0.85 L3MBTL1 (0.42) ALDH1A1NPSR1HPGDKDM4EL3MBTL1
SCHEMBL4883870 0.85 ALDH1A1 (0.48) ALDH1A1NPSR1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL4895640 0.84 KDM4E (0.53) ALDH1A1RAB9AKDM4E
SCHEMBL4893189 0.83 L3MBTL1 (0.41) ALDH1A1NPSR1HPGDKDM4ESMN1; SMN2
SCHEMBL4886340 0.83 TSHR (0.51) ALDH1A1NPSR1SMN1; SMN2L3MBTL1
SCHEMBL4889473 0.82 L3MBTL1 (0.52) ALDH1A1NPSR1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL4889525 0.82 SMN1; SMN2 (0.44) ALDH1A1NPSR1HPGDRAB9ACPS1

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 ALDH1A1 276/4885NPSR1 2465/4885HPGD 1356/4885

“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.