SCHEMBL19280489

SCHEMBL19280489

O=C1CS/C(=C/c2nc3c(s2)CSc2ccccc2-3)N1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADAMTS5 Q9UNA0 20/20 1.00
ADAMTS13 Q76LX8 2/20 0.53
ADAM17 P78536 1/20 0.53
ADAMTS4 O75173 1/20 0.47
MMP14 P50281 1/20 0.47

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
SCHEMBL3428710 0.67 L3MBTL1 (0.50) ADAMTS5
SCHEMBL16735375 0.63 ADAMTS5 (0.59) ADAMTS5ADAMTS13ADAMTS4MMP14
SCHEMBL7781288 0.60 ADAMTS5 (0.43) ADAMTS5
SCHEMBL13323 0.60 ALDH1A1 (0.60)
SCHEMBL9094523 0.59 ADAMTS5 (0.42) ADAMTS5
Hydrochloric Acid SCHEMBL30648399 0.59 ALDH1A1 (0.58)
SCHEMBL10610934 0.58 ADAMTS5 (0.40) ADAMTS5
SCHEMBL5834274 0.58 KDR (0.41) ADAMTS5
SCHEMBL2477193 0.57 KDR (0.40) ADAMTS5
SCHEMBL69404 0.57 HPGD (0.48) ADAMTS5

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-20180009903-A1 MODULATING ADIPOSE TISSUE AND ADIPOGENESIS KATHOLIEKE UNIV LEUVEN KU LEUVEN RESEARCH & DEVELOPMENT (BE) 2018-01-11 US disclosed
EP-3209794-A1 MODULATING ADIPOSE TISSUE AND ADIPOGENESIS Katholieke Universiteit Leuven KU Leuven Research & Development (BE) 2017-08-30 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-20180009903-A1 MODULATING ADIPOSE TISSUE AND ADIPOGENESIS ADAMTS5, ADAMTS1, ADAMTS7 ADAMTS5 1/4885ADAMTS13 9/4885ADAM17 39/4885

“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.