SCHEMBL1156562

SCHEMBL1156562

CN(Cc1cc(Br)n(S(=O)(=O)c2cccc(Cl)c2)c1)C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 9/20 0.40
RIPK1 Q13546 1/20 0.39
STS P08842 1/20 0.38
RORC P51449 3/20 0.38
HTR2C P28335 1/20 0.38
SLC6A4 P31645 1/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP3A4 P08684 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL30089348 1.00 HTR6 (0.40) HTR6RIPK1STSRORCHTR2C
SCHEMBL1156487 0.89 HTR2C (0.36) RORCHTR2CSLC6A4
SCHEMBL30089413 0.89 HTR2C (0.36) HTR6RIPK1HTR2CSLC6A4
SCHEMBL1156621 0.89 HTR2C (0.42) HTR6HTR2CSLC6A4MEN1KMT2A
SCHEMBL2416549 0.88 RIPK1 (0.39) HTR6RIPK1HTR2CSLC6A4MEN1
SCHEMBL2407643 0.87 CHRM5 (0.42) HTR6ALDH1A1
SCHEMBL4411752 0.87 HTR2C (0.41) HTR6HTR2CSLC6A4MEN1KMT2A
SCHEMBL31754845 0.86 RORC (0.42) HTR6RORC
SCHEMBL1156158 0.86 LIMK2 (0.42) HTR6MEN1KMT2ACYP3A4ALDH1A1
SCHEMBL29262658 0.85 TNFSF11 (0.46) KMT2AALDH1A1

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-8048909-B2 Proton pump inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-11-01 US disclosed
EP-2336107-A2 Proton pump inhibitors Takeda Pharmaceutical Company Limited (JP) 2011-06-22 EP disclosed
US-20110028476-A1 PROTON PUMP INHIBITORS KAJINO MASAHIRO 2011-02-03 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-20110028476-A1 PROTON PUMP INHIBITORS HRH2, HRH4, CYP2C19 HTR6 1412/4885RIPK1 4091/4885STS 199/4885

“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.