SCHEMBL3576602

SCHEMBL3576602

O=S(=O)(Cl)c1ccc(F)c2ccccc12.O=S(=O)(Cl)c1cccc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
TSHR P16473 3/20 0.45
ALDH1A1 P00352 2/20 0.45
GAA P10253 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
F2 P00734 3/20 0.41
PRSS1 P07477 3/20 0.41
PRSS2 P07478 3/20 0.41
PRSS3 P35030 3/20 0.41
HTR6 P50406 2/20 0.41
ACLY P53396 1/20 0.41
HPRT1 P00492 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SCN1A P35498 2/20 0.39
SCN2A Q99250 2/20 0.39
SCN3A Q9NY46 2/20 0.39

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
SCHEMBL1339739 0.89 ALDH1A1 (0.53) TSHRALDH1A1GAAHTTNPSR1
SCHEMBL31605318 0.86 CA1 (0.63) CA1CA2CA9TSHRALDH1A1
SCHEMBL57524 0.86 CA1 (0.63) CA1CA2CA9TSHRALDH1A1
SCHEMBL29409606 0.86 CA1 (0.63) CA1CA2CA9TSHRALDH1A1
SCHEMBL1584839 0.84 CA1 (0.61) CA1CA2CA9TSHRALDH1A1
SCHEMBL1584838 0.84 CA1 (0.61) CA1CA2CA9TSHRALDH1A1
SCHEMBL11485250 0.80 HPRT1 (0.56) CA1CA2CA9TSHRALDH1A1
SCHEMBL7729945 0.80 CA1 (0.53) CA1CA2CA9TSHRALDH1A1
Dimethylamine SCHEMBL28365350 0.79 CA1 (0.55) CA1CA2CA9TSHRALDH1A1
SCHEMBL9165551 0.78 ALDH1A1 (0.48) CA1CA2CA9TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100048549-A1 Peptidomimetics selective for the somatostatin receptor subtypes 1 and/or 4 Wurster, Siegfried (FI) 2010-02-25 US disclosed
EP-1885693-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 Wurster, Siegfried (FI) 2008-02-13 EP disclosed
WO-2006123020-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 JUVANTIA PHARMA LTD OY (FI) 2006-11-23 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-20100048549-A1 Peptidomimetics selective for the somatostatin receptor subtypes 1 and/or 4 SSTR1, SSTR4, SSTR3 CA1 2542/4885CA2 1930/4885CA9 2003/4885

“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.