SCHEMBL25232455

SCHEMBL25232455

O=C(O)N1CC2(C1)CN(c1cn[nH]c(=O)c1Br)C2

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TRPC5 Q9UL62 9/20 0.47
▸ TIPARP Q7Z3E1 5/20 0.39
▸ POLB P06746 4/20 0.35
▸ ALDH1A1 P00352 3/20 0.35

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
SCHEMBL20818174 0.82 NR1H2 (0.46) TRPC5TIPARP
SCHEMBL25275764 0.82 TRPC5 (0.60) TRPC5TIPARPPOLBALDH1A1
SCHEMBL20817920 0.80 TRPC5 (0.48) TRPC5TIPARPPOLBALDH1A1
SCHEMBL20818595 0.76 TRPC5 (0.74) TRPC5TIPARPALDH1A1
SCHEMBL25230738 0.72 TRPC5 (0.46) TRPC5TIPARPPOLBALDH1A1
SCHEMBL20818546 0.69 TRPC5 (0.49) TRPC5TIPARPPOLBALDH1A1
SCHEMBL20818370 0.69 TRPC5 (0.56) TRPC5TIPARPPOLB
SCHEMBL20818111 0.69 TRPC5 (0.56) TRPC5TIPARPPOLB
SCHEMBL20817850 0.69 TRPC5 (0.58) TRPC5TIPARPPOLBALDH1A1
SCHEMBL20831227 0.68 POLB (0.68) TRPC5TIPARPPOLBALDH1A1

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-20230203028-A1 PYRIDAZINONES AND METHODS OF USE THEREOF GFB (ABC), LLC 2023-06-29 — — 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-20230203028-A1 PYRIDAZINONES AND METHODS OF USE THEREOF PDXK, ATP6V1B1, REN TRPC5 1439/4885TIPARP 3091/4885POLB 1701/4885

“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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