SCHEMBL19195307

SCHEMBL19195307

C/C=C/n1ncn(CC)c1=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 2/20 0.33
▸ PDE4A P27815 1/20 0.30
▸ ADORA2A P29274 1/20 0.30
▸ ADORA2B P29275 1/20 0.30
▸ PDE4B Q07343 1/20 0.30
▸ PDE4C Q08493 1/20 0.30
▸ PDE4D Q08499 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
SCHEMBL19195169 1.00 NFE2L2 (0.33) NFE2L2PDE4AADORA2AADORA2BPDE4B
SCHEMBL19196400 0.86 PDE4A (0.36) NFE2L2PDE4AADORA2AADORA2BPDE4B
SCHEMBL19195306 0.86 PDE4A (0.36) NFE2L2PDE4AADORA2AADORA2BPDE4B
SCHEMBL19196408 0.81 ADORA2B (0.31) NFE2L2ADORA2B
SCHEMBL19195389 0.81 NFE2L2 (0.31) NFE2L2
SCHEMBL19195402 0.81 NFE2L2 (0.31) NFE2L2
SCHEMBL19195396 0.81 ADORA2B (0.31) NFE2L2ADORA2B
SCHEMBL19195550 0.80 PDE4A (0.35) NFE2L2PDE4AADORA2AADORA2BPDE4B
SCHEMBL19195390 0.80 PDE4A (0.35) NFE2L2PDE4AADORA2AADORA2BPDE4B
SCHEMBL19196409 0.78 NFE2L2 (0.32) NFE2L2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9845307-B2 Nrf2 activating compounds and uses thereof MIDCAP FINANCIAL TRUST 2017-12-19 — — US disclosed
US-20170217922-A1 Nrf2 Activating Compounds and Uses Thereof MIDCAP FINANCIAL TRUST 2017-08-03 — — 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-20170217922-A1 Nrf2 Activating Compounds and Uses Thereof NFE2L2, KEAP1, NQO1 NFE2L2 1/4885PDE4A 984/4885ADORA2A 1540/4885

“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.

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