SCHEMBL13548367

SCHEMBL13548367

C=C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.66
HTT P42858 2/20 0.66
ALDH1A1 P00352 1/20 0.66
POLB P06746 1/20 0.66
CD4 P01730 5/20 0.61
KMT2A Q03164 4/20 0.60
MEN1 O00255 3/20 0.60
GAA P10253 2/20 0.58
LMNA P02545 2/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
HSD11B1 P28845 1/20 0.56
TSHR P16473 1/20 0.56
CYP2C19 P33261 1/20 0.56

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
SCHEMBL8203532 0.85 PKM (0.88) PKMHTTALDH1A1POLBKMT2A
SCHEMBL3971438 0.85 PKM (0.88) PKMHTTALDH1A1POLBKMT2A
SCHEMBL8200466 0.85 PKM (0.88) PKMHTTALDH1A1POLBKMT2A
SCHEMBL4537086 0.85 PKM (0.88) PKMHTTALDH1A1POLBKMT2A
SCHEMBL10724066 0.85 PKM (0.88) PKMHTTALDH1A1POLBKMT2A
SCHEMBL699639 0.85 PKM (0.88) PKMHTTALDH1A1POLBKMT2A
SCHEMBL565301 0.85 PKM (0.88) PKMHTTALDH1A1POLBKMT2A
SCHEMBL3303527 0.85 PKM (0.88) PKMHTTALDH1A1POLBKMT2A
SCHEMBL505093 0.84 KMT2A (0.69) PKMHTTALDH1A1POLBKMT2A
SCHEMBL8218091 0.82 PKM (0.54) PKMALDH1A1CD4KMT2AMEN1

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-9074028-B2 Complexes of ruthenum, method for their preparation, and their application in olefin metathesis reactions UMICORE AG & CO. KG (DE) 2015-07-07 US disclosed
US-20140171607-A1 New Complexes of Ruthenium, Method for Their Preparation, and Their Application in Olefin Metathesis Reactions UMICORE AG & CO. KG (DE) 2014-06-19 US disclosed
US-7645774-B2 Cannabinoid receptor ligands SCHERING CORPORATION (US) 2010-01-12 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-20140171607-A1 New Complexes of Ruthenium, Method for Their Preparation, and Their Application in Olefin Metathesis Reactions CYP2F1, FIS1, CYP4F11 PKM 3886/4885HTT 4412/4885ALDH1A1 2199/4885

“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.