SCHEMBL24009290

SCHEMBL24009290

OC1CCC(SS[C@H]2CC[C@H](O)CC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
EPHX2 P34913 1/20 0.33
SHBG P04278 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
SCHEMBL24837527 1.00 TSHR (0.41) TSHREPHX2SHBG
SCHEMBL10789621 1.00 TSHR (0.41) TSHREPHX2SHBG
SCHEMBL161333 0.79 TSHR (0.41) TSHREPHX2SHBG
SCHEMBL28182 0.76
SCHEMBL3389566 0.76 TSHR (0.64) TSHREPHX2SHBG
SCHEMBL8036941 0.76 TSHR (0.64) TSHREPHX2SHBG
SCHEMBL102859 0.76
SCHEMBL1593359 0.76 TSHR (0.64) TSHREPHX2SHBG
SCHEMBL2700308 0.76 TSHR (0.64) TSHREPHX2SHBG
SCHEMBL275681 0.76

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-11780849-B2 Imino sulfanone inhibitors of ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2023-10-10 US disclosed
WO-2021225969-A1 IMINO SULFANONE INHIBITORS OF ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2021-11-11 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-11780849-B2 Imino sulfanone inhibitors of ENPP1 ENPP1, ENPP3, SMPD1 TSHR 4083/4885EPHX2 1237/4885SHBG 3175/4885

“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.