SCHEMBL4873342

SCHEMBL4873342

CC(C)[C@@H]([C@@H](C)O)N1CCCC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.33
FDPS P14324 2/20 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
SCHEMBL2167974 0.97 SMN1; SMN2 (0.36) SMN1; SMN2FDPS
SCHEMBL4873469 0.82 SMN1; SMN2 (0.32) SMN1; SMN2FDPS
SCHEMBL13024053 0.80 FDPS (0.35) SMN1; SMN2FDPS
SCHEMBL14008530 0.80 FDPS (0.35) SMN1; SMN2FDPS
SCHEMBL13066092 0.74 SMN1; SMN2 (0.37) SMN1; SMN2FDPS
SCHEMBL4866498 0.74
SCHEMBL17377285 0.72 SMN1; SMN2 (0.35) SMN1; SMN2FDPS
SCHEMBL20905549 0.72 SMN1; SMN2 (0.35) SMN1; SMN2FDPS
SCHEMBL486195 0.72 SMN1; SMN2 (0.35) SMN1; SMN2FDPS
SCHEMBL4876275 0.72

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-7335781-B2 Aminothiol compound HUEY JIIN CO., LTD. (TW) 2008-02-26 US disclosed
US-7335781-B2 Aminothiol compound HUEY JIIN CO., LTD. (TW) 2008-02-26 US disclosed
US-7335781-B2 Aminothiol compound HUEY JIIN CO., LTD. (TW) 2008-02-26 US disclosed
US-20040181057-A1 perform as superior catalysts in asymmetric addition reactions wherein organic zinc and aldehyde are involved; Such catalyses are economically useful for industries HUEY JIIN CO., LTD. (TW) 2004-09-16 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-20040181057-A1 perform as superior catalysts in asymmetric addition reactions wherein organic zinc and aldehyde are involved; Such catalyses are economically useful for industries ALDH7A1, ALDH3A1, ALDH1A1 SMN1; SMN2 4102/4885FDPS 1181/4885

“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.