SCHEMBL6577087

SCHEMBL6577087

S[C@@H]1CN[C@H](CO[C@@H]2CCNC2)C1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.37
SLC6A4 P31645 4/20 0.37
SLC6A3 Q01959 4/20 0.37
KCNH2 Q12809 4/20 0.37
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35

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 SCHEMBL6424622 0.98 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3KCNH2CHRM2
Hydrochloric Acid SCHEMBL6578137 0.98 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3KCNH2CHRM2
SCHEMBL29090678 0.74 LTA4H (0.39) SLC6A2SLC6A4SLC6A3KCNH2CHRM2
SCHEMBL29090679 0.74 LTA4H (0.39) SLC6A2SLC6A4SLC6A3KCNH2CHRM2
SCHEMBL15166134 0.71 CHRM2 (0.41) SLC6A2SLC6A4SLC6A3KCNH2CHRM2
SCHEMBL1243239 0.71 CHRM2 (0.41) SLC6A2SLC6A4SLC6A3KCNH2CHRM2
SCHEMBL492706 0.71 CHRM2 (0.41) SLC6A2SLC6A4SLC6A3KCNH2CHRM2
Hydrochloric Acid SCHEMBL15156872 0.70 CHRM2 (0.40) SLC6A2SLC6A4SLC6A3KCNH2CHRM2
Hydrochloric Acid SCHEMBL15156875 0.70 CHRM2 (0.40) SLC6A2SLC6A4SLC6A3KCNH2CHRM2
SCHEMBL13531423 0.65

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-20040236118-A1 Pyrrolidine derivatives and method of synthesizing these EIZAI CO., LTD (JP) 2004-11-25 US disclosed
EP-1413574-A1 PYRROLIDINE DERIVATIVES AND METHOD OF SYNTHESIZING THESE Eizai Co., Ltd. (JP) 2004-04-28 EP 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-20040236118-A1 Pyrrolidine derivatives and method of synthesizing these ADH1C, ADH5, ADH1A SLC6A2 3620/4885SLC6A4 2588/4885SLC6A3 2524/4885

“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.