SCHEMBL30458159

SCHEMBL30458159

CCOC(=O)c1cc2c([nH]1)CN(C(=O)OCc1ccccc1)CC2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 17/20 0.53
SIGMAR1 Q99720 17/20 0.53
HRH2 P25021 4/20 0.52
HTR2C P28335 4/20 0.52
HRH1 P35367 4/20 0.52
HTR1E P28566 3/20 0.52
HTR1A P08908 3/20 0.52
HTR2A P28223 3/20 0.52
HTR2B P41595 3/20 0.52
CHRM5 P08912 2/20 0.52
ADRA1D P25100 2/20 0.52
HTR1B P28222 2/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A3 Q01959 1/20 0.52
KDR P35968 1/20 0.48
ADRA2A P08913 3/20 0.47
ADRA2B P18089 3/20 0.47
HRH3 Q9Y5N1 3/20 0.47
DRD3 P35462 2/20 0.47
PTGDR2 Q9Y5Y4 2/20 0.46

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
SCHEMBL31607740 0.92 TMEM97 (0.53) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL1655581 0.82 NOTUM (0.41) HRH3
SCHEMBL10702359 0.82 SMN1; SMN2 (0.42) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL977882 0.81 ADORA1 (0.48)
SCHEMBL977652 0.81 MEN1 (0.52)
SCHEMBL30458160 0.78 TMEM97 (0.54) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL30458157 0.78 TMEM97 (0.54) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL7075795 0.77 KDR (0.49) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL4399188 0.77 TMEM97 (0.49) TMEM97SIGMAR1HRH2HTR2CHRH1
SCHEMBL3441575 0.76 TMEM97 (0.52) TMEM97SIGMAR1HRH2HTR2CHRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240409542-A1 NOVEL COMPOUNDS SITRYX THERAPEUTICS LIMITED (GB) 2024-12-12 US disclosed
EP-4408845-A1 NOVEL COMPOUNDS Sitryx Therapeutics Limited (GB) 2024-08-07 EP disclosed
WO-2023052783-A1 NOVEL COMPOUNDS SITRYX THERAPEUTICS LIMITED (GB) 2023-04-06 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-20240409542-A1 NOVEL COMPOUNDS CD47, GPR119, LRBA TMEM97 4352/4885SIGMAR1 3984/4885HRH2 3171/4885

“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.