SCHEMBL4537090

SCHEMBL4537090

Cc1ccc(S(=O)(=O)N2[CH]C2)cc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.59
HTT P42858 2/20 0.57
MMP2 P08253 1/20 0.57
ALDH1A1 P00352 1/20 0.57
POLB P06746 1/20 0.57
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
GAA P10253 3/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
ACHE P22303 1/20 0.52
TSHR P16473 1/20 0.52
CYP2C19 P33261 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.49
RECQL P46063 1/20 0.49

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
SCHEMBL28461319 0.79 CA1 (0.49) PKMHTTMMP2ALDH1A1POLB
SCHEMBL258778 0.78 PKM (0.66) PKMHTTMMP2ALDH1A1POLB
SCHEMBL27519797 0.78 PKM (0.58) PKMHTTMMP2ALDH1A1POLB
SCHEMBL28461353 0.78 CA1 (0.47) PKMHTTMMP2ALDH1A1POLB
SCHEMBL8203532 0.77 PKM (0.88) PKMHTTALDH1A1POLBGAA
SCHEMBL4537086 0.77 PKM (0.88) PKMHTTALDH1A1POLBGAA
SCHEMBL699639 0.77 PKM (0.88) PKMHTTALDH1A1POLBGAA
SCHEMBL565301 0.77 PKM (0.88) PKMHTTALDH1A1POLBGAA
SCHEMBL10724066 0.77 PKM (0.88) PKMHTTALDH1A1POLBGAA
SCHEMBL8200466 0.77 PKM (0.88) PKMHTTALDH1A1POLBGAA

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
EP-1985624-A2 Single step method of radiofluorination of biologically active compounds or biomolecules Bayer Schering Pharma Aktiengesellschaft (DE) 2008-10-29 EP claimed
US-20090022664-A1 Radiolabelling via fluorination of aziridines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2009-01-22 US disclosed
EP-1985624-A2 Single step method of radiofluorination of biologically active compounds or biomolecules Bayer Schering Pharma Aktiengesellschaft (DE) 2008-10-29 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-20090022664-A1 Radiolabelling via fluorination of aziridines TMEM14C, ARFGEF1, NPFFR1 PKM 2534/4885HTT 993/4885MMP2 4745/4885

“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.