SCHEMBL26667705

SCHEMBL26667705

CC/C=C\c1ncccn1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 1/20 0.36
▸ MEN1 O00255 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ATM Q13315 1/20 0.33

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
SCHEMBL14782956 0.87 CDK1 (0.33) —
SCHEMBL28082047 0.78 FAAH (0.33) —
SCHEMBL737125 0.76 — —
SCHEMBL23837700 0.75 AOC1 (0.38) MEN1NPC1RAB9AKMT2AATM
SCHEMBL6762869 0.75 MEN1 (0.33) MEN1NPC1RAB9AKMT2AATM
SCHEMBL6159326 0.75 MEN1 (0.33) MEN1NPC1RAB9AKMT2AATM
SCHEMBL20189661 0.75 PDE2A (0.33) PDE2A
SCHEMBL20189663 0.75 PDE2A (0.33) PDE2A
SCHEMBL256048 0.75 NPC1 (0.62) MEN1NPC1RAB9AKMT2AATM
SCHEMBL456987 0.75 NPC1 (0.62) MEN1NPC1RAB9AKMT2AATM

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-20230339907-A1 PROCESS FOR THE PREPARATION OF QUATERNIZED PYRIDAZINE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2023-10-26 — — 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-20230339907-A1 PROCESS FOR THE PREPARATION OF QUATERNIZED PYRIDAZINE DERIVATIVES DHPS, PDXK, NQO1 PDE2A 1226/4885MEN1 931/4885NPC1 3638/4885

“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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