SCHEMBL20511465

SCHEMBL20511465

CCCCOC(=O)[C@H](CCC(N)=O)NCCNCCN

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 4/20 0.37
RAB9A P51151 2/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 2/20 0.33
DPP7 Q9UHL4 1/20 0.32
HTR2C P28335 1/20 0.32
ACHE P22303 6/20 0.32
ATM Q13315 1/20 0.32
NPC1 O15118 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL29080980 0.88 NOD1 (0.43) NOD1RAB9AMAPTNPSR1ALDH1A1
SCHEMBL3228662 0.84 NOD1 (0.42) NOD1DPP7HTR2C
SCHEMBL2120818 0.84 NOD1 (0.44) NOD1HTR2CACHE
SCHEMBL27812060 0.82 NOD1 (0.46) NOD1NPSR1HTR2CACHE
SCHEMBL27631472 0.79 L3MBTL1 (0.34) NOD1ALDH1A1SMN1; SMN2
SCHEMBL28223725 0.78 NOD1 (0.47) NOD1NPSR1HTR2CACHE
SCHEMBL20511491 0.77 GGT1 (0.50) NOD1ALDH1A1
SCHEMBL468919 0.76 NOD1 (0.45) NOD1RAB9AMAPTNPSR1ALDH1A1
SCHEMBL468917 0.76 NOD1 (0.45) NOD1RAB9AMAPTNPSR1ALDH1A1
SCHEMBL28337313 0.76 NOD1 (0.43) NOD1DPP7HTR2CACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180303944-A1 THERAPEUTIC COMPOSITIONS AND METHODS FOR TREATMENT OF MUSCLE WASTING DISEASES OREGON STATE UNIVERSITY (US) 2018-10-25 US claimed
WO-2018176065-A1 THERAPEUTIC COMPOSITIONS AND METHODS FOR TREATMENT OF MUSCLE WASTING DISEASES OREGON STATE UNIVERSITY (US) 2018-09-27 WO claimed
US-10905766-B2 Therapeutic compositions and methods for treatment of muscle wasting diseases OREGON STATE UNIVERSITY (US) 2021-02-02 US disclosed
US-20180303944-A1 THERAPEUTIC COMPOSITIONS AND METHODS FOR TREATMENT OF MUSCLE WASTING DISEASES OREGON STATE UNIVERSITY (US) 2018-10-25 US disclosed
WO-2018176065-A1 THERAPEUTIC COMPOSITIONS AND METHODS FOR TREATMENT OF MUSCLE WASTING DISEASES OREGON STATE UNIVERSITY (US) 2018-09-27 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 (2 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-20180303944-A1 THERAPEUTIC COMPOSITIONS AND METHODS FOR TREATMENT OF MUSCLE WASTING DISEASES TNNC1, PYGM, MYLK2 NOD1 4770/4885RAB9A 2300/4885MAPT 2838/4885
US-10905766-B2 Therapeutic compositions and methods for treatment of muscle wasting diseases TNNC1, PYGM, MYLK2 NOD1 4770/4885RAB9A 2300/4885MAPT 2838/4885

“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.