SCHEMBL12860652

SCHEMBL12860652

CS(=O)(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.56
ENPP2 Q13822 2/20 0.50
LMNA P02545 2/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PTPRZ1 P23471 1/20 0.48
PTGS2 P35354 5/20 0.44
ESPL1 Q14674 1/20 0.44
POLB P06746 1/20 0.42

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
SCHEMBL1098295 0.81 GAA (0.54) KIF11LMNAALDH1A1MAPK1HTT
SCHEMBL14227525 0.79 ENPP2 (0.48) KIF11ENPP2ALDH1A1SMN1; SMN2PTGS2
SCHEMBL2376239 0.79 ENPP2 (0.72) ENPP2PTGS2
SCHEMBL12860655 0.79 ALDH1A1 (0.48) KIF11LMNAALDH1A1ESPL1POLB
SCHEMBL17689398 0.78 ALDH1A1 (0.64) KIF11ENPP2ALDH1A1SMN1; SMN2PTGS2
SCHEMBL7937243 0.78 ALDH1A1 (0.52) KIF11LMNAALDH1A1MAPK1HTT
SCHEMBL517720 0.78 ALDH1A1 (0.52) KIF11LMNAALDH1A1MAPK1HTT
SCHEMBL10145040 0.77 ALDH1A1 (0.69) KIF11LMNAALDH1A1MAPK1HTT
SCHEMBL8505532 0.77 LMNA (0.44) KIF11LMNAMAPK1HTTSMN1; SMN2
SCHEMBL1098294 0.76 LMNA (0.50) KIF11LMNAALDH1A1MAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10308605-B2 Proton pump inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-06-04 US disclosed
EP-2336107-B1 Proton pump inhibitors TAKEDA PHARMACEUTICAL (JP) 2015-09-23 EP disclosed
EP-1803709-B1 PROTON PUMP INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2013-01-02 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 (2 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-10308605-B2 Proton pump inhibitors HRH2, HRH4, HRH1 KIF11 3160/4885ENPP2 2783/4885LMNA 3457/4885
US-20110028476-A1 PROTON PUMP INHIBITORS HRH2, HRH4, CYP2C19 KIF11 3911/4885ENPP2 2350/4885LMNA 3735/4885

“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.