SCHEMBL21870596

SCHEMBL21870596

CC(C)CNC1CCS(=N)(=O)C1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSK P43235 1/20 0.33
EPHX1 P07099 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
CA2 P00918 2/20 0.30

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
SCHEMBL23665158 1.00 CTSK (0.33) CTSKEPHX1ALDH1A1MAPTCA2
SCHEMBL21870609 0.89 SMYD3 (0.33) CTSKEPHX1CA2
SCHEMBL21870595 0.81 ALDH1A1 (0.48) CTSKALDH1A1MAPT
SCHEMBL21870591 0.81 ALDH1A1 (0.48) CTSKALDH1A1MAPT
SCHEMBL24010077 0.81 KCNH2 (0.35) ALDH1A1MAPT
SCHEMBL11205801 0.81 ALDH1A1 (0.48) CTSKALDH1A1MAPT
SCHEMBL21660824 0.76 CTSK (0.39) CTSKEPHX1ALDH1A1MAPTCA2
SCHEMBL24909670 0.71 NFE2L2 (0.37) CTSKEPHX1ALDH1A1MAPTCA2
SCHEMBL11203880 0.69 SMN1; SMN2 (0.46) ALDH1A1MAPT
SCHEMBL24010075 0.68 KCNH2 (0.38) ALDH1A1MAPT

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-20210221796-A1 ANTIBACTERIAL COMPOUNDS BLACKSMITH MEDICINES, INC. 2021-07-22 US disclosed
WO-2020061375-A1 ANTIBACTERIAL COMPOUNDS FORGE THERAPEUTICS, INC. (US) 2020-03-26 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-20210221796-A1 ANTIBACTERIAL COMPOUNDS SPOUT1, MRPL21, NRDC CTSK 249/4885EPHX1 3871/4885ALDH1A1 2040/4885

“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.