SCHEMBL2741402

SCHEMBL2741402

Cc1ccc(S(=O)(=O)N2C/C=C\CCCC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.64
ALDH1A1 P00352 4/20 0.63
POLB P06746 1/20 0.63
HTT P42858 1/20 0.63
KMT2A Q03164 4/20 0.60
MEN1 O00255 3/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
HSD17B10 Q99714 1/20 0.55
HSD11B1 P28845 1/20 0.55
LMNA P02545 1/20 0.54
USP2 O75604 1/20 0.53
TDP1 Q9NUW8 1/20 0.52
KDM4E B2RXH2 1/20 0.51
GAA P10253 1/20 0.50
MAPK1 P28482 1/20 0.50
TSHR P16473 1/20 0.50
CYP2C19 P33261 1/20 0.50

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
SCHEMBL1932281 0.95 PKM (0.65) PKMALDH1A1POLBHTTKMT2A
SCHEMBL1930631 0.89 PKM (0.61) PKMALDH1A1POLBHTTKMT2A
SCHEMBL13625328 0.84 PKM (0.72) PKMALDH1A1POLBHTTKMT2A
SCHEMBL258778 0.83 PKM (0.66) PKMALDH1A1POLBHTTKMT2A
SCHEMBL436674 0.83 PKM (0.89) PKMALDH1A1POLBHTTKMT2A
SCHEMBL5564371 0.81 KMT2A (0.86) PKMALDH1A1POLBHTTKMT2A
SCHEMBL31476293 0.81 ALDH1A1 (0.92) PKMALDH1A1POLBHTTKMT2A
SCHEMBL15945283 0.81 KMT2A (0.86) PKMALDH1A1POLBHTTKMT2A
SCHEMBL7645597 0.81 KMT2A (0.86) PKMALDH1A1POLBHTTKMT2A
SCHEMBL18484219 0.81 KMT2A (0.86) PKMALDH1A1POLBHTTKMT2A

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2116302-B1 Catalyst complex with a heterocyclic carbene ligand UNIV OF NEW ORLEANS FOUND (US) 2017-02-22 EP disclosed
US-20160243535-A1 CATALYST COMPLEX WITH CARBENE LIGAND MATERIA, INC. 2016-08-25 US disclosed
US-20160243535-A1 CATALYST COMPLEX WITH CARBENE LIGAND MATERIA, INC. 2016-08-25 US disclosed
US-9339805-B2 Catalyst complex with carbene ligand MATERIA, INC. (US) 2016-05-17 US disclosed
US-9339805-B2 Catalyst complex with carbene ligand MATERIA, INC. (US) 2016-05-17 US disclosed
US-9233365-B2 Catalyst complex with carbene ligand MATERIA, INC. (US) 2016-01-12 US disclosed
US-9233365-B2 Catalyst complex with carbene ligand MATERIA, INC. (US) 2016-01-12 US disclosed
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
US-20150202610-A1 CATALYST COMPLEX WITH CARBENE LIGAND MATERIA, INC. (US) 2015-07-23 US disclosed
US-20120004418-A1 Catalyst Complex With Carbene Ligand MATERIA, INC. 2012-01-05 US disclosed
US-7902389-B2 Catalyst complex with carbene ligand MATERIA, INC. 2011-03-08 US disclosed
US-7902389-B2 Catalyst complex with carbene ligand MATERIA, INC. 2011-03-08 US disclosed
US-20100160642-A1 Catalyst Complex With Carbene Ligand UNIVERSITY OF NEW ORLEANS RESEARCH & TECHNOLOGY FOUNDATION, INC. (US) 2010-06-24 US disclosed
US-20100160642-A1 Catalyst Complex With Carbene Ligand UNIVERSITY OF NEW ORLEANS RESEARCH & TECHNOLOGY FOUNDATION, INC. (US) 2010-06-24 US disclosed
US-7622590-B1 Including a metal atom having anionic ligands, at least one nucleophilic carbene ligand, and an alkylidene, vinylidene, or allenylidene ligand; complexes are highly stable to air, moisture and thermal degradation; designed to efficiently carry out a variety of olefin metathesis reactions UNIVERSITY OF NEW ORLEANS FOUNDATION (US) 2009-11-24 US disclosed
US-7622590-B1 Including a metal atom having anionic ligands, at least one nucleophilic carbene ligand, and an alkylidene, vinylidene, or allenylidene ligand; complexes are highly stable to air, moisture and thermal degradation; designed to efficiently carry out a variety of olefin metathesis reactions UNIVERSITY OF NEW ORLEANS FOUNDATION (US) 2009-11-24 US disclosed
EP-2116302-A1 Catalyst complex with a heterocyclic carbene ligand University Of New Orleans Foundation (US) 2009-11-11 EP disclosed
EP-1115491-B1 CATALYST COMPLEX WITH PHENYLINDENYLIDENE LIGAND UNIV NEW ORLEANS FOUNDATION (US) 2009-08-05 EP disclosed
US-7348290-B2 Ring-opening or closing metathesis reaction of olefin; reduction of carbonyl compound, catalysis, complexing; cyclization, reduction JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2008-03-25 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 (5 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-20120004418-A1 Catalyst Complex With Carbene Ligand ZC3H18, ZC3HAV1L, PDCD1LG2 PKM 3618/4885ALDH1A1 3385/4885POLB 1027/4885
US-20150202610-A1 CATALYST COMPLEX WITH CARBENE LIGAND ZC3HAV1L, PDCD1LG2, ICOSLG PKM 3652/4885ALDH1A1 3335/4885POLB 919/4885
US-20100160642-A1 Catalyst Complex With Carbene Ligand ZC3H18, ZC3HAV1L, PDCD1LG2 PKM 3618/4885ALDH1A1 3385/4885POLB 1027/4885
US-20160243535-A1 CATALYST COMPLEX WITH CARBENE LIGAND ZC3HAV1L, PDCD1LG2, ICOSLG PKM 3652/4885ALDH1A1 3335/4885POLB 919/4885
US-20150322079-A1 LOW CATALYST LOADING IN METATHESIS REACTIONS APEX1, PMS2, MAX PKM 1682/4885ALDH1A1 2091/4885POLB 384/4885

“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.