SCHEMBL356099

SCHEMBL356099

COC(=O)C1CCCC1CCCI

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM3 P20309 1/20 0.38
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL356569 0.95 CHRM2 (0.37) CHRM2CHRM4CHRM3TSHRHTT
SCHEMBL20569111 0.82 CHRM2 (0.42) CHRM2CHRM4CHRM3SMN1; SMN2SLC6A2
SCHEMBL8175970 0.82 CHRM2 (0.42) CHRM2CHRM4CHRM3SMN1; SMN2SLC6A2
SCHEMBL29315034 0.81 HTT (0.43) CHRM2CHRM4CHRM3TSHRHTT
SCHEMBL22447718 0.79 CHRM2 (0.42) CHRM2CHRM4CHRM3SLC6A2SLC6A4
SCHEMBL12144141 0.77 SLC6A2 (0.38) CHRM2CHRM4CHRM3TSHRHTT
SCHEMBL12140495 0.77 CA1 (0.47) CHRM2CHRM4CHRM3TSHRHTT
SCHEMBL4135152 0.77 CHRM2 (0.43) CHRM2CHRM4CHRM3TSHRHTT
SCHEMBL4135155 0.77 CHRM2 (0.43) CHRM2CHRM4CHRM3TSHRHTT
SCHEMBL4135157 0.77 CHRM2 (0.43) CHRM2CHRM4CHRM3TSHRHTT

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
EP-2560976-B9 FUROPYRIDINE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2017-06-07 EP disclosed
EP-2560976-B1 FUROPYRIDINE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2016-08-24 EP disclosed
EP-2560976-A1 FUROPYRIDINE COMPOUNDS AND USES THEREOF Novartis AG (CH) 2013-02-27 EP disclosed
US-8324239-B2 Furopyridine compounds and uses thereof NOVARTIS AG (CH) 2012-12-04 US disclosed
US-20120015907-A1 Furopyridine compounds and uses thereof NOVARTIS AG (CH) 2012-01-19 US disclosed
WO-2011131709-A1 FUROPYRIDINE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2011-10-27 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 (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-20120015907-A1 Furopyridine compounds and uses thereof CYP3A5, QDPR, DPYD CHRM2 835/4885CHRM4 967/4885CHRM3 708/4885

“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.