SCHEMBL4887092

SCHEMBL4887092

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

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CPS1 P31327 15/20 0.52
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.50
RAB9A P51151 1/20 0.49

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
SCHEMBL4887096 0.85 ALDH1A1 (0.51) CPS1ALDH1A1HPGDRAB9A
SCHEMBL4892518 0.81 KDM4E (0.48) ALDH1A1HPGDRAB9A
SCHEMBL4889261 0.81 LMNA (0.46) ALDH1A1HPGDRAB9A
SCHEMBL2835948 0.76 PARP1 (0.55) ALDH1A1HPGDRAB9A
SCHEMBL14314760 0.76 CHRNB2 (0.65) ALDH1A1HPGD
SCHEMBL3911050 0.74 CPS1 (0.60) CPS1ALDH1A1HPGDRAB9A
SCHEMBL4908569 0.73 ALDH1A1 (0.47) CPS1ALDH1A1HPGDRAB9A
SCHEMBL4908582 0.73 ALDH1A1 (0.47) CPS1ALDH1A1HPGDRAB9A
SCHEMBL7016460 0.72 SMN1; SMN2 (0.57) ALDH1A1RAB9A
SCHEMBL4896886 0.72 KDM4E (0.39) ALDH1A1HPGDRAB9A

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 CPS1 6/4885ALDH1A1 276/4885HPGD 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.