SCHEMBL13212937

SCHEMBL13212937

CN(C)C(=O)[C@@H]1CCN(C(C)(C)C)C1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 1/20 0.41
▸ NOTUM Q6P988 1/20 0.40
▸ CYP2D6 P10635 1/20 0.35
▸ PDK2 Q15119 2/20 0.34
▸ ATM Q13315 1/20 0.34
▸ DPP4 P27487 2/20 0.34
▸ CYP46A1 Q9Y6A2 5/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ PDE10A Q9Y233 1/20 0.32
▸ PIK3CD O00329 1/20 0.31

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
SCHEMBL10205037 1.00 BCHE (0.41) BCHENOTUMCYP2D6PDK2ATM
SCHEMBL13212938 1.00 BCHE (0.41) BCHENOTUMCYP2D6PDK2ATM
SCHEMBL10205147 0.89 BCHE (0.49) BCHENOTUMATMDPP4MEN1
SCHEMBL10205100 0.89 CYP2D6 (0.37) BCHENOTUMCYP2D6PDK2DPP4
SCHEMBL17886878 0.84 ATM (0.42) BCHENOTUMPDK2ATMDPP4
SCHEMBL17672370 0.83 ATM (0.34) ATMSMN1; SMN2
SCHEMBL20244607 0.83 BCHE (0.48) BCHEDPP4CYP46A1SMN1; SMN2HSD17B10
SCHEMBL25474849 0.79 ATM (0.37) ATMSMN1; SMN2LMNA
SCHEMBL11977462 0.79 LMNA (0.46) NOTUMATMLMNA
SCHEMBL15188004 0.79 LMNA (0.46) NOTUMATMLMNA

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-20100197908-A1 Pyridazine Derivatives with MCH Antagonistic Activity and Medicaments Comprising These Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-08-05 — — US disclosed
US-20100197908-A1 Pyridazine Derivatives with MCH Antagonistic Activity and Medicaments Comprising These Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-08-05 — — 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-20100197908-A1 Pyridazine Derivatives with MCH Antagonistic Activity and Medicaments Comprising These Compounds MCHR1, MCHR2, MC5R BCHE 2412/4885NOTUM 4429/4885CYP2D6 1784/4885

“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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