SCHEMBL5149939

SCHEMBL5149939

CC(C)(O)[CH]c1ccc(F)nc1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.37
CYP2A6 P11509 3/20 0.35
CYP2B6 P20813 3/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C19 P33261 2/20 0.35
OGA O60502 1/20 0.31
CYP2E1 P05181 1/20 0.31
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30

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
SCHEMBL25403948 0.73
SCHEMBL17846281 0.73 PTGS1 (0.44) NFE2L2
SCHEMBL5527620 0.69 TNKS (0.40) CYP2A6CYP2B6CYP3A4CYP2C19OGA
SCHEMBL15516669 0.69 NFE2L2 (0.46) NFE2L2CYP2A6CYP2B6CYP3A4CYP2C19
SCHEMBL17288189 0.69 CYP11B1 (0.40) CYP2A6CYP2B6CYP3A4CYP2C19CYP11B1
SCHEMBL114139 0.69
SCHEMBL9908261 0.69
SCHEMBL3071412 0.69
SCHEMBL114830 0.69
SCHEMBL30454177 0.69

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-20070219228-A1 Aryl substituted imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY 2007-09-20 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-20070219228-A1 Aryl substituted imidazonaphthyridines IL2, IRF3, EIF2AK2 NFE2L2 715/4885CYP2A6 653/4885CYP2B6 771/4885

“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.