SCHEMBL2679103

SCHEMBL2679103

O=C(Nc1c(S(=O)(=O)O)cc(O)c2ccccc12)Nc1c(S(=O)(=O)O)cc(O)c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MPL P40238 6/20 0.51
PRMT1 Q99873 1/20 0.47
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
LDHA P00338 1/20 0.42
NSD2 O96028 2/20 0.42
CASP6 P55212 2/20 0.42
MMP14 P50281 1/20 0.42
HKDC1 Q2TB90 2/20 0.41
TNNI3 P19429 1/20 0.41
TNNT2 P45379 1/20 0.41
TNNC1 P63316 1/20 0.41
NT5E P21589 1/20 0.40
CTRC Q99895 1/20 0.40
DUSP3 P51452 1/20 0.40
PTPN5 P54829 1/20 0.40
CASP7 P55210 1/20 0.40
PTPN11 Q06124 1/20 0.40

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
SCHEMBL11347286 0.86 TIMP3 (0.49) MPLPRMT1CA1CA2CASP6
SCHEMBL11339069 0.83 KMT2A (0.53) PRMT1CA1CA2NSD2
SCHEMBL10396176 0.82 MPL (0.53) MPLLDHANSD2CASP6MMP14
SCHEMBL11339023 0.81 CA12 (0.47) PRMT1CA1CA2
SCHEMBL10907712 0.81 MPL (0.46) MPLPRMT1CA1CA2CASP6
SCHEMBL11435352 0.81 CASP6 (0.55) MPLPRMT1CA1CA2CASP6
SCHEMBL11348931 0.80 HPSE (0.45) MPLPRMT1CA1CA2NSD2
SCHEMBL10823467 0.79 IDH1 (0.58) CA1CA2
SCHEMBL10823484 0.79 IDH1 (0.52) PRMT1CA1CA2
SCHEMBL11207461 0.79 KDM4E (0.49) MPLPRMT1CA1CA2CASP6

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-8175860-B2 Method of inhibiting the growth of Helicobacter pylori NATIONAL TSING HUA UNIVERSITY (TW) 2012-05-08 US disclosed
US-20100305152-A1 METHOD OF INHIBITING THE GROWTH OF HELICOBACTER PYLORI NATIONAL TSING HUA UNIVERSITY (TW) 2010-12-02 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-20100305152-A1 METHOD OF INHIBITING THE GROWTH OF HELICOBACTER PYLORI HPD, HAAO, HK1 MPL 4334/4885PRMT1 3728/4885CA1 1754/4885

“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.