SCHEMBL20831553

SCHEMBL20831553

C[C@@H]1CN(Cc2ccccc2C(F)(F)F)C(=O)CN1c1cn[nH]c(=O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPC5 Q9UL62 8/20 0.48
▸ KCNH2 Q12809 1/20 0.48
▸ TRPC4 Q9UBN4 1/20 0.48
▸ MKNK1 Q9BUB5 1/20 0.39
▸ MKNK2 Q9HBH9 1/20 0.39
▸ TAS2R8 Q9NYW2 1/20 0.38
▸ SIRT2 Q8IXJ6 1/20 0.36
▸ SIRT1 Q96EB6 1/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ HTR2C P28335 1/20 0.36
▸ PIK3C3 Q8NEB9 1/20 0.36
▸ DPP4 P27487 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ COMT P21964 1/20 0.35
▸ P2RX7 Q99572 1/20 0.35
▸ C5AR1 P21730 1/20 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
SCHEMBL20831958 0.81 TRPC5 (0.68) TRPC5KCNH2TRPC4
SCHEMBL20831957 0.81 TRPC5 (0.68) TRPC5KCNH2TRPC4
SCHEMBL20831554 0.81 TRPC5 (0.68) TRPC5KCNH2TRPC4
SCHEMBL24433243 0.72 TRPC5 (0.69) TRPC5KCNH2TRPC4P2RX7
SCHEMBL20818071 0.70 TRPC5 (0.69) TRPC5KCNH2TRPC4P2RX7
SCHEMBL20831288 0.70 TRPC5 (0.69) TRPC5KCNH2TRPC4P2RX7
SCHEMBL20818056 0.70 TRPC5 (0.69) TRPC5KCNH2TRPC4P2RX7
SCHEMBL20831508 0.68 TRPC5 (0.57) TRPC5KCNH2TRPC4NPSR1KDM4E
SCHEMBL25687168 0.67 TRPC5 (0.80) TRPC5KCNH2TRPC4
SCHEMBL20831652 0.67 TRPC5 (0.59) TRPC5KCNH2TRPC4NPSR1KDM4E

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 1439/4885KCNH2 915/4885TRPC4 2143/4885

“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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