SCHEMBL657708

SCHEMBL657708

O=C(O)/C=C(\CCc1ccc(Cl)cc1F)c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 8/20 0.76
FFAR1 O14842 2/20 0.42
FFAR4 Q5NUL3 2/20 0.42
PPARG P37231 3/20 0.39
PPARA Q07869 3/20 0.39
PPARD Q03181 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
PTGER1 P34995 1/20 0.38
GRM5 P41594 1/20 0.37
HPD P32754 1/20 0.37
TP53 P04637 1/20 0.37
HTR1A P08908 1/20 0.37
HTR2A P28223 1/20 0.37
HTR7 P34969 1/20 0.37
HTR6 P50406 1/20 0.37
TBXA2R P21731 1/20 0.37
PTGFR P43088 1/20 0.37
PTGER3 P43115 1/20 0.37
PTGER2 P43116 1/20 0.37
PTGIR P43119 1/20 0.37

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
SCHEMBL657709 1.00 PDPK1 (0.76) PDPK1FFAR1FFAR4PPARGPPARA
SCHEMBL657710 1.00 PDPK1 (0.76) PDPK1FFAR1FFAR4PPARGPPARA
SCHEMBL657333 0.86 PDPK1 (1.00) PDPK1MRGPRX4TBXA2RPTGFRPTGER3
SCHEMBL657332 0.86 PDPK1 (1.00) PDPK1MRGPRX4TBXA2RPTGFRPTGER3
SCHEMBL657331 0.86 PDPK1 (1.00) PDPK1MRGPRX4TBXA2RPTGFRPTGER3
SCHEMBL657774 0.84 PDPK1 (1.00) PDPK1FFAR1FFAR4HPD
SCHEMBL29890619 0.84 PDPK1 (1.00) PDPK1FFAR1FFAR4HPD
SCHEMBL657775 0.84 PDPK1 (1.00) PDPK1FFAR1FFAR4HPD
SCHEMBL13386089 0.84 PDPK1 (0.73) PDPK1FFAR1FFAR4
SCHEMBL657773 0.84 PDPK1 (1.00) PDPK1FFAR1FFAR4HPD

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2349999-B1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIV SAARLAND (DE) 2016-01-27 EP claimed
US-8912186-B2 Allosteric protein kinase modulators UNIVERSITAET DES SAARLANDES (DE) 2014-12-16 US claimed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US claimed
EP-2349999-A1 ALLOSTERIC PROTEIN KINASE MODULATORS Universität des Saarlandes (DE) 2011-08-03 EP claimed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO claimed
EP-2177510-A1 Allosteric protein kinase modulators Universität des Saarlandes (DE) 2010-04-21 EP claimed
EP-2349999-B1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIV SAARLAND (DE) 2016-01-27 EP disclosed
US-8912186-B2 Allosteric protein kinase modulators UNIVERSITAET DES SAARLANDES (DE) 2014-12-16 US disclosed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US disclosed
EP-2349999-A1 ALLOSTERIC PROTEIN KINASE MODULATORS Universität des Saarlandes (DE) 2011-08-03 EP disclosed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO disclosed
EP-2177510-A1 Allosteric protein kinase modulators Universität des Saarlandes (DE) 2010-04-21 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-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS AURKC, AURKA, AURKB PDPK1 109/4885FFAR1 4188/4885FFAR4 4271/4885

“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.