SCHEMBL20831709

SCHEMBL20831709

CCc1ncccc1C(CC)N1CCN(c2cnn(PI)c(=O)c2C#N)CC1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 4/20 0.35
▸ PARP1 P09874 1/20 0.31
▸ KDM4D Q6B0I6 1/20 0.31
▸ DRD2 P14416 1/20 0.30
▸ HTR2A P28223 1/20 0.30
▸ HRH1 P35367 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
SCHEMBL20817941 0.80 TRPC5 (0.43) GRM2PARP1KDM4D
SCHEMBL20817940 0.80 TRPC5 (0.43) GRM2PARP1KDM4D
SCHEMBL20817982 0.80 TRPC5 (0.43) GRM2PARP1KDM4D
SCHEMBL20817999 0.80 ATR (0.33) GRM2PARP1
SCHEMBL20831817 0.77 TRPC5 (0.39) —
SCHEMBL25715316 0.74 TRPC5 (0.42) GRM2PARP1KDM4D
SCHEMBL20818847 0.70 TRPC5 (0.60) —
SCHEMBL20818843 0.70 TRPC5 (0.60) —
SCHEMBL20818997 0.70 TRPC5 (0.60) —
SCHEMBL25233062 0.66 MEN1 (0.42) —

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-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 GRM2 1720/4885PARP1 3298/4885KDM4D 2552/4885

“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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