SCHEMBL1444701

SCHEMBL1444701

CC(C)/C(=C1\C(=O)N(Cc2cccc(C(=O)O)c2)c2ccccc21)c1ccc(C(F)(F)F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRKAG1 P54619 12/20 1.00
PRKAB1 Q9Y478 12/20 1.00
PRKAA1 Q13131 2/20 1.00
PRKAA2 P54646 10/20 0.78
KMT2A Q03164 1/20 0.51
MAPT P10636 2/20 0.48
TP53 P04637 3/20 0.47
CHRM5 P08912 1/20 0.47
POLB P06746 1/20 0.45

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
SCHEMBL25692285 0.94 PRKAG1 (0.88) PRKAG1PRKAB1PRKAA1PRKAA2KMT2A
SCHEMBL25735821 0.93 PRKAG1 (0.86) PRKAG1PRKAB1PRKAA1PRKAA2MAPT
SCHEMBL1444551 0.90 PRKAG1 (0.82) PRKAG1PRKAB1PRKAA1PRKAA2MAPT
SCHEMBL1445160 0.90 PRKAG1 (0.82) PRKAG1PRKAB1PRKAA1PRKAA2KMT2A
SCHEMBL1444589 0.89 PRKAG1 (0.81) PRKAG1PRKAB1PRKAA1PRKAA2KMT2A
SCHEMBL1445170 0.89 PRKAG1 (0.84) PRKAG1PRKAB1PRKAA1PRKAA2KMT2A
SCHEMBL1443226 0.88 PRKAG1 (1.00) PRKAG1PRKAB1PRKAA1PRKAA2KMT2A
SCHEMBL12812675 0.88 PRKAG1 (0.82) PRKAG1PRKAB1PRKAA1PRKAA2KMT2A
SCHEMBL1444449 0.88 PRKAG1 (1.00) PRKAG1PRKAB1PRKAA1PRKAA2KMT2A
SCHEMBL1444396 0.88 PRKAG1 (0.78) PRKAG1PRKAB1PRKAA1PRKAA2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140288127-A1 Novel Alkene Oxindole Derivatives F. HOFFMANN-LA ROCHE AG (CH) 2014-09-25 US claimed
US-8778973-B2 Alkene oxindole derivatives HOFFMANN-LAROCHE INC. (US) 2014-07-15 US claimed
US-20130131114-A1 NOVEL ALKENE OXINDOLE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2013-05-23 US claimed
EP-2480530-A1 ALKENE OXINDOLE DERIVATIVES AND THEIR USES TO TREAT OBESITY, DIABETES AND HYPERLIPIDEMIA F. Hoffmann-La Roche AG (CH) 2012-08-01 EP claimed
WO-2011033099-A1 ALKENE OXINDOLE DERIVATIVES AND THEIR USES TO TREAT OBESITY, DIABETES AND HYPERLIPIDEMIA F. HOFFMANN-LA ROCHE AG (CH) 2011-03-24 WO claimed
US-20110071195-A1 NOVEL ALKENE OXINDOLE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-03-24 US claimed
WO-2011032320-A1 NOVEL ALKENE OXINDOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-03-24 WO claimed
US-20240024490-A1 BIFUNCTIONAL MOLECULES FOR SELECTIVE MODIFICATION OF TARGET SUBSTRATES THE BROAD INSTITUTE, INC. 2024-01-25 US disclosed
US-20230192904-A1 BIFUNCTIONAL CHIMERIC MOLECULES FOR LABELING OF KINASES WITH TARGET BINDING MOIETIES AND METHODS OF USE THEREOF THE BROAD INSTITUTE, INC. 2023-06-22 US disclosed
US-20230117831-A1 MULTI-FUNCTIONAL CHIMERIC MOLECULES THE BROAD INSTITUTE, INC. 2023-04-20 US disclosed
WO-2020212597-A1 p16INK4a INHIBITOR FOR PREVENTING OR TREATING HUNTINGTON'S DISEASE SORBONNE UNIVERSITE (FR) 2020-10-22 WO disclosed
US-20140288127-A1 Novel Alkene Oxindole Derivatives F. HOFFMANN-LA ROCHE AG (CH) 2014-09-25 US disclosed
US-20140288127-A1 Novel Alkene Oxindole Derivatives F. HOFFMANN-LA ROCHE AG (CH) 2014-09-25 US disclosed
WO-2011033099-A1 ALKENE OXINDOLE DERIVATIVES AND THEIR USES TO TREAT OBESITY, DIABETES AND HYPERLIPIDEMIA F. HOFFMANN-LA ROCHE AG (CH) 2011-03-24 WO disclosed
WO-2011033099-A1 ALKENE OXINDOLE DERIVATIVES AND THEIR USES TO TREAT OBESITY, DIABETES AND HYPERLIPIDEMIA F. HOFFMANN-LA ROCHE AG (CH) 2011-03-24 WO disclosed
US-20110071195-A1 NOVEL ALKENE OXINDOLE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-03-24 US disclosed
US-20110071195-A1 NOVEL ALKENE OXINDOLE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-03-24 US disclosed
US-20110071195-A1 NOVEL ALKENE OXINDOLE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-03-24 US disclosed
WO-2011032320-A1 NOVEL ALKENE OXINDOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-03-24 WO disclosed
WO-2011032320-A1 NOVEL ALKENE OXINDOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-03-24 WO 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 (6 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-20230117831-A1 MULTI-FUNCTIONAL CHIMERIC MOLECULES PHAX, PAICS, SARS1 PRKAG1 1292/4885PRKAB1 2161/4885PRKAA1 506/4885
US-20240024490-A1 BIFUNCTIONAL MOLECULES FOR SELECTIVE MODIFICATION OF TARGET SUBSTRATES COASY, JMJD7, PTMS PRKAG1 1921/4885PRKAB1 2744/4885PRKAA1 1000/4885
US-20230192904-A1 BIFUNCTIONAL CHIMERIC MOLECULES FOR LABELING OF KINASES WITH TARGET BINDING MOIETIES AND METHODS OF USE THEREOF ERBB2, ACP1, TK1 PRKAG1 211/4885PRKAB1 208/4885PRKAA1 133/4885
US-20140288127-A1 Novel Alkene Oxindole Derivatives PRKAB1, PRKAR2A, PRKAB2 PRKAG1 5/4885PRKAB1 1/4885PRKAA1 8/4885
US-20110071195-A1 NOVEL ALKENE OXINDOLE DERIVATIVES PRKAB1, PRKAR2A, PRKAB2 PRKAG1 5/4885PRKAB1 1/4885PRKAA1 10/4885
US-20130131114-A1 NOVEL ALKENE OXINDOLE DERIVATIVES PRKAB1, PRKAR2A, PRKAB2 PRKAG1 5/4885PRKAB1 1/4885PRKAA1 8/4885

“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.