SCHEMBL2642018

SCHEMBL2642018

CSc1ccc(OC(C)=O)c(C=Cc2ccc(C(=O)O)cn2)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCK P35557 2/20 0.70
RAB9A P51151 4/20 0.44
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 3/20 0.44
TSHR P16473 2/20 0.44
GAA P10253 1/20 0.44
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
HPGD P15428 4/20 0.43
MAPT P10636 3/20 0.43
LMNA P02545 3/20 0.43
NPC1 O15118 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
TP53 P04637 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NFKB1 P19838 1/20 0.43
MAPK1 P28482 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL2642015 1.00 GCK (0.70) GCKRAB9AALDH1A1KDM4ETSHR
SCHEMBL2642055 0.83 GCK (1.00) GCKRAB9AKDM4EKMT2AHPGD
SCHEMBL2642100 0.83 GCK (1.00) GCKRAB9AKDM4EKMT2AHPGD
SCHEMBL2642006 0.82 GCK (0.64) GCKALDH1A1HPGDRARARARB
SCHEMBL2642009 0.82 GCK (0.64) GCKALDH1A1HPGDRARARARB
SCHEMBL2642024 0.79 GCK (0.80) GCKRAB9AKDM4EKMT2AHPGD
SCHEMBL2642026 0.79 GCK (0.80) GCKRAB9AKDM4EKMT2AHPGD
SCHEMBL2398634 0.75 GCK (0.55) GCKRAB9AALDH1A1KDM4EGAA
SCHEMBL2398633 0.75 GCK (0.55) GCKRAB9AALDH1A1KDM4EGAA
SCHEMBL14519324 0.72 GCK (0.79) GCKRAB9AALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070093535-A1 Vinyl phenyl derivatives as GLK activators ASTRAZENECA AB 2007-04-26 US disclosed
US-7199140-B2 Vinyl phenyl derivatives as GLK activators ASTRAZENECA AB (SE) 2007-04-03 US disclosed
EP-1406620-B1 VINYL PHENYL DERIVATIVES AS GLK ACTIVATORS ASTRAZENECA AB (SE) 2006-11-02 EP disclosed
US-20050054715-A1 Vinyl phenyl derivatives as glk activators ASTRAZENECA AB (SE) 2005-03-10 US disclosed
EP-1406620-A1 VINYL PHENYL DERIVATIVES AS GLK ACTIVATORS Astrazeneca AB (SE) 2004-04-14 EP disclosed
WO-2003000262-A1 VINYL PHENYL DERIVATIVES AS GLK ACTIVATORS ASTRAZENECA AB (SE) 2003-01-03 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 (2 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-20050054715-A1 Vinyl phenyl derivatives as glk activators GCK, GCKR, GK GCK 1/4885RAB9A 3969/4885ALDH1A1 1706/4885
US-20070093535-A1 Vinyl phenyl derivatives as GLK activators GCK, GCKR, GK GCK 1/4885RAB9A 3881/4885ALDH1A1 1641/4885

“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.