SCHEMBL21087447

SCHEMBL21087447

Cc1c(Br)cnc(Cl)c1N=O

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 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
SCHEMBL18947601 0.80 — —
SCHEMBL13674820 0.77 — —
SCHEMBL12528297 0.77 HTT (0.36) ALDH1A1
SCHEMBL20704188 0.74 CHRNB2 (0.32) ALDH1A1
SCHEMBL12051933 0.74 CCNA2 (0.36) —
SCHEMBL31229804 0.73 CHRNB2 (0.31) ALDH1A1
Nitrous Acid SCHEMBL28883343 0.70 ALDH1A1 (0.41) ALDH1A1
SCHEMBL16913805 0.69 PIK3C3 (0.35) —
SCHEMBL20203264 0.69 — —
SCHEMBL22695577 0.69 ALDH1A1 (0.30) ALDH1A1

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-10662189-B2 PDE4 inhibitor Shijiazhuang Sagacity New Drug Development Co., Ltd. (CN) 2020-05-26 — — US disclosed
US-20190177318-A1 PDE4 INHIBITOR MEDSHINE DISCOVERY INC. (CN) 2019-06-13 — — 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 (2 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-20190177318-A1 PDE4 INHIBITOR PDE4A, PDE12, PDE4B ALDH1A1 363/4885
US-10662189-B2 PDE4 inhibitor PDE4A, PDE12, PDE4B ALDH1A1 363/4885

“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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