SCHEMBL13625328

SCHEMBL13625328

Cc1ccc(S(=O)(=O)N2CC/C=C\CCC2)cc1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PKM P14618 4/20 0.72
ALDH1A1 P00352 4/20 0.72
HTT P42858 3/20 0.72
POLB P06746 1/20 0.72
KMT2A Q03164 4/20 0.64
MEN1 O00255 3/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
LMNA P02545 3/20 0.60
HSD17B10 Q99714 1/20 0.57
USP2 O75604 1/20 0.56
GAA P10253 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
KDM4E B2RXH2 1/20 0.54

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
SCHEMBL13536909 0.93 PKM (0.70) PKMALDH1A1HTTPOLBKMT2A
SCHEMBL1932281 0.89 PKM (0.65) PKMALDH1A1HTTPOLBKMT2A
SCHEMBL8193968 0.86 PKM (0.96) PKMALDH1A1HTTPOLBKMT2A
SCHEMBL10409988 0.86 PKM (0.96) PKMALDH1A1HTTPOLBKMT2A
SCHEMBL4102676 0.86 PKM (0.96) PKMALDH1A1HTTPOLBKMT2A
SCHEMBL436674 0.86 PKM (0.89) PKMALDH1A1HTTPOLBKMT2A
SCHEMBL1930631 0.85 PKM (0.61) PKMALDH1A1HTTPOLBKMT2A
SCHEMBL8502340 0.84 PKM (1.00) PKMALDH1A1HTTPOLBKMT2A
SCHEMBL7953663 0.84 PKM (1.00) PKMALDH1A1HTTPOLBKMT2A
SCHEMBL5564371 0.84 KMT2A (0.86) PKMALDH1A1HTTPOLBKMT2A

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-20150322079-A1 LOW CATALYST LOADING IN METATHESIS REACTIONS EVONIK INDUSTRIES AG (DE) 2015-11-12 US disclosed
US-20150322079-A1 LOW CATALYST LOADING IN METATHESIS REACTIONS EVONIK INDUSTRIES AG (DE) 2015-11-12 US disclosed
EP-2711351-A1 Low catalyst loading in metathesis reactions Evonik Industries AG (DE) 2014-03-26 EP disclosed
US-7612008-B2 Metathesis catalysts LANXESS DEUTSCHLAND GMBH (DE) 2009-11-03 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-20150322079-A1 LOW CATALYST LOADING IN METATHESIS REACTIONS APEX1, PMS2, MAX PKM 1682/4885ALDH1A1 2091/4885HTT 3193/4885

“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.