SCHEMBL10205147

SCHEMBL10205147

CN(C)C(=O)C1CCCN(C(C)(C)C)C1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 4/20 0.49
▸ DPP4 P27487 2/20 0.37
▸ PIK3CD O00329 1/20 0.37
▸ NOTUM Q6P988 1/20 0.36
▸ EIF2AK4 Q9P2K8 1/20 0.35
▸ HTT P42858 1/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ ITGB3 P05106 1/20 0.34
▸ ITGA2B P08514 1/20 0.34
▸ F2R P25116 1/20 0.34
▸ JAK2 O60674 1/20 0.34
▸ JAK3 P52333 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ DGAT2 Q96PD7 2/20 0.33
▸ ATM Q13315 1/20 0.33
▸ POLB P06746 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32

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
SCHEMBL13212937 0.89 BCHE (0.41) BCHEDPP4PIK3CDNOTUMMEN1
SCHEMBL10205037 0.89 BCHE (0.41) BCHEDPP4PIK3CDNOTUMMEN1
SCHEMBL13212938 0.89 BCHE (0.41) BCHEDPP4PIK3CDNOTUMMEN1
SCHEMBL3964578 0.84 BCHE (0.36) BCHEHTTMEN1KMT2AITGB3
SCHEMBL14350101 0.82 BCHE (0.55) BCHEHTTKDM4EPOLBALDH1A1
SCHEMBL17886878 0.81 ATM (0.42) BCHEDPP4NOTUMATMPOLB
SCHEMBL12102748 0.80 ALDH1A1 (0.49) MEN1KMT2AKDM4EPOLBALDH1A1
SCHEMBL11923163 0.80 ALDH1A1 (0.36) BCHEDPP4MEN1KMT2AATM
SCHEMBL21042943 0.80 ALDH1A1 (0.49) MEN1KMT2AKDM4EPOLBALDH1A1
SCHEMBL4971987 0.80 ALDH1A1 (0.36) BCHEDPP4MEN1KMT2AATM

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220315568-A1 INHIBITORS OF SARM1 DISARM THERAPEUTICS, INC. 2022-10-06 — — US disclosed
US-20120010185-A1 NEW PYRIDONE DERIVATES WITH MCH ANTAGONISTIC ACTIVITY AND MEDICAMENTS COMPRISING THESE COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-01-12 — — US disclosed
US-8067590-B2 Melanin-concentrating hormone (MCH) receptor antagonists; treating obesity, eating disorders, affective disorders, drug dependency; compounds are amino-functional pyridazin-3-one, 1H-pyridin-2-one or 3H-pyrimidin-4-one BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-29 — — 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
US-20080255083-A1 NEW PYRIDONE DERIVATES WITH MCH ANTAGONISTIC ACTIVITY AND MEDICAMENTS COMPRISING THESE COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-10-16 — — US disclosed
US-20070111981-A1 New (hetero)aryl compounds with MCH antagonistic activity and medicaments comprising these compounds ROTH GERALD J 2007-05-17 — — 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 (5 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-20070111981-A1 New (hetero)aryl compounds with MCH antagonistic activity and medicaments comprising these compounds MCHR1, GPR119, MCHR2 BCHE 2189/4885DPP4 922/4885PIK3CD 4088/4885
US-20120010185-A1 NEW PYRIDONE DERIVATES WITH MCH ANTAGONISTIC ACTIVITY AND MEDICAMENTS COMPRISING THESE COMPOUNDS MCHR1, MCHR2, GPR119 BCHE 2359/4885DPP4 797/4885PIK3CD 3592/4885
US-20100197908-A1 Pyridazine Derivatives with MCH Antagonistic Activity and Medicaments Comprising These Compounds MCHR1, MCHR2, MC5R BCHE 2412/4885DPP4 662/4885PIK3CD 4168/4885
US-20080255083-A1 NEW PYRIDONE DERIVATES WITH MCH ANTAGONISTIC ACTIVITY AND MEDICAMENTS COMPRISING THESE COMPOUNDS MCHR1, MCHR2, GPR119 BCHE 2359/4885DPP4 797/4885PIK3CD 3592/4885
US-20220315568-A1 INHIBITORS OF SARM1 SARM1, SMN1; SMN2, SARNP BCHE 2539/4885DPP4 3330/4885PIK3CD 2812/4885

“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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