SCHEMBL22247140

SCHEMBL22247140

CCSc1ccc([C@H](CO)CC[S@+]([O-])C(C)(C)C)cc1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 8/20 0.33
MAOA P21397 1/20 0.32

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
SCHEMBL19201251 0.74 SLC6A4 (0.45) SLC6A4MAOA
SCHEMBL28725351 0.71 SLC6A4 (0.36) SLC6A4MAOA
SCHEMBL29488706 0.71 SLC6A4 (0.36) SLC6A4MAOA
SCHEMBL17710286 0.71 SLC6A4 (0.36) SLC6A4MAOA
SCHEMBL19201197 0.66 SLC6A4 (0.40) SLC6A4MAOA
SCHEMBL17688579 0.65 SLC6A4 (0.50) SLC6A4MAOA
SCHEMBL17688578 0.65 SLC6A4 (0.50) SLC6A4MAOA
SCHEMBL29070030 0.64 PTGS2 (0.37) SLC6A4MAOA
SCHEMBL11076527 0.64 SLC6A4 (0.48) SLC6A4MAOA
Hydrochloric Acid SCHEMBL17710304 0.63 SLC6A4 (0.49) SLC6A4MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200231597-A1 BICYLIC COMPOUND ACTING AS AN INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2020-07-23 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-20200231597-A1 BICYLIC COMPOUND ACTING AS AN INHIBITOR RORC, RORB, RORA SLC6A4 4497/4885MAOA 2319/4885

“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.