SCHEMBL20831216

SCHEMBL20831216

NC(=O)CN1CCN(c2cn[nH]c(=O)c2Br)CC1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TRPC5 Q9UL62 10/20 0.60
▸ HSP90AA1 P07900 1/20 0.52
▸ HSP90AB1 P08238 1/20 0.52
▸ ALDH1A1 P00352 4/20 0.42
▸ POLB P06746 3/20 0.42
▸ TIPARP Q7Z3E1 1/20 0.42

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
SCHEMBL20831217 0.83 TRPC5 (0.56) TRPC5HSP90AA1HSP90AB1ALDH1A1POLB
SCHEMBL25694464 0.80 TRPC5 (0.60) TRPC5HSP90AA1HSP90AB1ALDH1A1POLB
SCHEMBL25275764 0.79 TRPC5 (0.60) TRPC5ALDH1A1POLBTIPARP
SCHEMBL20831227 0.77 POLB (0.68) TRPC5HSP90AA1HSP90AB1ALDH1A1POLB
SCHEMBL20818445 0.77 TRPC5 (0.61) TRPC5ALDH1A1POLBTIPARP
SCHEMBL20818507 0.77 TRPC5 (0.61) TRPC5ALDH1A1POLBTIPARP
SCHEMBL20817850 0.75 TRPC5 (0.58) TRPC5HSP90AA1HSP90AB1ALDH1A1POLB
SCHEMBL25694641 0.75 TRPC5 (1.00) TRPC5HSP90AA1HSP90AB1ALDH1A1POLB
SCHEMBL20831221 0.74 TRPC5 (1.00) TRPC5ALDH1A1POLB
SCHEMBL20817915 0.73 TRPC5 (0.50) TRPC5ALDH1A1POLB

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 3 patents. 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
US-20230203028-A1 PYRIDAZINONES AND METHODS OF USE THEREOF GFB (ABC), LLC 2023-06-29 — — US disclosed
WO-2019055966-A2 PYRIDAZINONES AND METHODS OF USE THEREOF GOLDFINCH BIO, INC. (US) 2019-03-21 — — WO 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 1439/4885HSP90AA1 3784/4885HSP90AB1 3824/4885

“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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