SCHEMBL20511491

SCHEMBL20511491

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GGT1 P19440 1/20 0.50
FOLH1 Q04609 3/20 0.41
KMT2A Q03164 2/20 0.40
ALOX15 P16050 2/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40
MMP2 P08253 2/20 0.38
MMP9 P14780 2/20 0.38
NOD1 Q9Y239 1/20 0.37
CA2 P00918 5/20 0.37
CA1 P00915 4/20 0.37
LMNA P02545 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
CA12 O43570 1/20 0.37
CA3 P07451 1/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 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
SCHEMBL27546759 0.90 GGT1 (0.61) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL15387334 0.90 GGT1 (0.61) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL29964294 0.88 FOLH1 (0.53) GGT1FOLH1ALOX15NOD1CA2
SCHEMBL29964946 0.87 FOLH1 (0.42) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL8633803 0.86 GGT1 (0.49) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL29448584 0.86 MAOA (0.45) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL30199558 0.85 FOLH1 (0.49) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL6428434 0.83 FOLH1 (0.47) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL5495877 0.83 FOLH1 (0.47) GGT1FOLH1KMT2AALOX15BLM
SCHEMBL6428433 0.83 FOLH1 (0.47) GGT1FOLH1KMT2AALOX15BLM

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-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
CN-113616815-B pH responsive T 1 /T 2 Switching type MRI contrast agent and preparation method and application thereof 中国科学院苏州纳米技术与纳米仿生研究所 2022-11-22 CN disclosed
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 GGT1 2447/4885FOLH1 2135/4885KMT2A 2685/4885
US-10905766-B2 Therapeutic compositions and methods for treatment of muscle wasting diseases TNNC1, PYGM, MYLK2 GGT1 2447/4885FOLH1 2135/4885KMT2A 2685/4885

“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.