SCHEMBL4892473

SCHEMBL4892473

O=C(O)c1ccc2ccn3c2c1C=CC3

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.32
WDR5 P61964 1/20 0.32
LDHA P00338 1/20 0.31

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
SCHEMBL10934358 0.70 NOTUM (0.33) CYP1A2
SCHEMBL2287964 0.68
SCHEMBL2043273 0.63 CYP1A2 (0.58) CYP1A2WDR5LDHA
SCHEMBL10011896 0.63 CYP1A2 (0.52) CYP1A2WDR5LDHA
SCHEMBL10012511 0.62 CYP1A2 (0.41) CYP1A2WDR5
SCHEMBL9365693 0.60 HSD17B10 (0.46) CYP1A2WDR5LDHA
SCHEMBL11568763 0.60 CYP1A2 (0.38) CYP1A2
SCHEMBL31649984 0.59
SCHEMBL898994 0.57 CYP1A2 (0.72) CYP1A2WDR5LDHA
SCHEMBL36891321 0.56 ALDH1A1 (0.43)

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-20080221090-A1 HCV NS5B Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2008-09-11 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-20080221090-A1 HCV NS5B Inhibitors EIF2AK2, HAVCR2, EIF5B CYP1A2 362/4885WDR5 2086/4885LDHA 4414/4885

“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.