SCHEMBL20831766

SCHEMBL20831766

CC[C@@H]1CNCCN1c1cn[nH]c(=O)c1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 17/20 0.50
▸ SLC6A4 P31645 17/20 0.50
▸ SLC6A3 Q01959 17/20 0.50
▸ CYP2D6 P10635 14/20 0.50
▸ ROCK2 O75116 2/20 0.44
▸ ROCK1 Q13464 1/20 0.42
▸ HTR2C P28335 1/20 0.37

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
SCHEMBL20818632 0.77 SLC6A4 (0.46) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL14900034 0.76 SLC6A2 (0.83) SLC6A2SLC6A4SLC6A3CYP2D6ROCK2
SCHEMBL20818107 0.75 POLB (0.49) SLC6A2SLC6A4SLC6A3CYP2D6ROCK2
SCHEMBL20818612 0.75 TRPC5 (0.46) SLC6A2SLC6A4SLC6A3CYP2D6ROCK2
SCHEMBL28168047 0.72 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3CYP2D6ROCK2
SCHEMBL29221981 0.72 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CYP2D6ROCK2
SCHEMBL7149297 0.71 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL20129705 0.71 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3CYP2D6ROCK2
SCHEMBL5757671 0.70 CHRNB2 (0.53) SLC6A4CYP2D6HTR2C
SCHEMBL5631728 0.70 SLC6A4 (0.51) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C

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 SLC6A2 332/4885SLC6A4 524/4885SLC6A3 777/4885

“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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