SCHEMBL2469949

SCHEMBL2469949

[c]1nscc1-c1nnco1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 14/20 0.38
TSHR P16473 1/20 0.33
MAPT P10636 2/20 0.32
ALDH1A1 P00352 2/20 0.32
TLR8 Q9NR97 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
HPGD P15428 1/20 0.31
MAPK1 P28482 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
SCHEMBL12906161 0.68 NOTUM (0.59) NOTUMTSHRMAPTALDH1A1TLR8
SCHEMBL539177 0.64 NOTUM (0.41) NOTUMTSHRALDH1A1LMNAHPGD
SCHEMBL22738890 0.63 NOTUM (0.48) NOTUMTSHRMAPTALDH1A1TLR8
SCHEMBL7255351 0.61 NOTUM (0.38) NOTUMTSHRMAPTALDH1A1TLR8
SCHEMBL28450882 0.61 NOTUM (0.38) NOTUMTSHRMAPTTLR8
SCHEMBL6050750 0.61 KMT2A (0.39) NOTUMMAPTALDH1A1LMNAHPGD
SCHEMBL1932823 0.60 GOT1 (0.31)
SCHEMBL17694561 0.60 NOTUM (0.78) NOTUMTSHRMAPTALDH1A1TLR8
SCHEMBL4760927 0.59 NOTUM (0.39) NOTUMTSHRMAPTALDH1A1TLR8
SCHEMBL4476133 0.59 NOTUM (0.48) NOTUMTSHRMAPTALDH1A1TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160237074-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC Foundation for Research Development (10 pp.) 2016-08-18 US disclosed
US-20130137728-A1 Compositions and Methods for the Treatment of Degenerative Diseases MUSC Foundation for Research and Development (US) 2013-05-30 US disclosed
EP-2550260-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DEGENERATIVE DISEASES Medical University Of South Carolina (US) 2013-01-30 EP disclosed
WO-2011119869-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DEGENERATIVE DISEASES MEDICAL UNIVERSITY OF SOUTH CAROLINA (US) 2011-09-29 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-20160237074-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR THE TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS PCSK9, ACHE, CLN6 NOTUM 111/4885TSHR 3863/4885MAPT 140/4885
US-20130137728-A1 Compositions and Methods for the Treatment of Degenerative Diseases REN, PCSK9, LIPA NOTUM 149/4885TSHR 3145/4885MAPT 230/4885

“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.