SCHEMBL18897724

SCHEMBL18897724

CCC(CN1CCCCC1)C(=O)c1ccc(C)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 5/20 0.77
CHRM2 P08172 2/20 0.69
ADRA2B P18089 2/20 0.69
DRD3 P35462 2/20 0.69
SIGMAR1 Q99720 2/20 0.69
HRH3 Q9Y5N1 2/20 0.69
ALDH1A1 P00352 3/20 0.68
LMNA P02545 2/20 0.68
CYP2D6 P10635 1/20 0.55
ADRA2C P18825 1/20 0.55
CHRM3 P20309 1/20 0.55
OPRD1 P41143 1/20 0.55
KCNH2 Q12809 1/20 0.55
SLC6A3 Q01959 7/20 0.52
SLC6A2 P23975 5/20 0.52
NPSR1 Q6W5P4 1/20 0.46
NTSR1 P30989 1/20 0.44
USP2 O75604 1/20 0.44
MITF O75030 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43

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
Hydrochloric Acid SCHEMBL29766065 0.99 SLC6A4 (0.75) SLC6A4CHRM2ADRA2BDRD3SIGMAR1
SCHEMBL4936687 0.87 SLC6A4 (1.00) SLC6A4CHRM2ADRA2BDRD3SIGMAR1
Hydrochloric Acid SCHEMBL9850462 0.86 HRH3 (0.71) SLC6A4CHRM2ADRA2BDRD3SIGMAR1
SCHEMBL6862360 0.86 SLC6A4 (0.69) SLC6A4CHRM2ADRA2BDRD3SIGMAR1
Hydrochloric Acid SCHEMBL29380532 0.85 ALDH1A1 (0.61) SLC6A4CHRM2ADRA2BDRD3SIGMAR1
SCHEMBL14068950 0.85 ALDH1A1 (0.60) SLC6A4CHRM2ADRA2BDRD3SIGMAR1
Tolperisone SCHEMBL4516510 0.82 CHRM2 (1.00) SLC6A4CHRM2ADRA2BDRD3SIGMAR1
Tolperisone SCHEMBL148499 0.82 CHRM2 (1.00) SLC6A4CHRM2ADRA2BDRD3SIGMAR1
SCHEMBL21451092 0.82 CHRM2 (1.00) SLC6A4CHRM2ADRA2BDRD3SIGMAR1
Tolperisone SCHEMBL17223884 0.82 CHRM2 (1.00) SLC6A4CHRM2ADRA2BDRD3SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200390754-A1 METHODS OF ADMINISTERING TOLPERISONE NEURANA PHARMACEUTICALS, INC. 2020-12-17 US disclosed
US-9662317-B2 Methods of administering tolperisone for therapeutic purposes SANOCHEMIA PHARMAZEUTIKA AG (AT) 2017-05-30 US 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-20200390754-A1 METHODS OF ADMINISTERING TOLPERISONE ACHE, THOP1, CHAT SLC6A4 20/4885CHRM2 107/4885ADRA2B 1071/4885

“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.