SCHEMBL1668845

SCHEMBL1668845

CS(=O)(=O)N1CCC(c2cc(F)c(OC3CN(Cc4nc(C(F)(F)F)cs4)C3)c(F)c2)CC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 3/20 0.40
SCN8A Q9UQD0 3/20 0.40
RORC P51449 1/20 0.34
ENPP2 Q13822 9/20 0.34
NPY5R Q15761 1/20 0.33
IDO1 P14902 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
GPR119 Q8TDV5 2/20 0.32
FPR2 P25090 1/20 0.31
PROKR1 Q8TCW9 1/20 0.31
CYP2C9 P11712 1/20 0.31
SCN5A Q14524 1/20 0.31
SCN9A Q15858 1/20 0.31
SCN2A Q99250 1/20 0.31
PDE4B Q07343 1/20 0.31

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
SCHEMBL1668473 0.93 SCN1A (0.40) SCN1ASCN8ARORCENPP2NPY5R
SCHEMBL1669062 0.86 SCN8A (0.40) SCN1ASCN8ARORCENPP2NPY5R
SCHEMBL12198401 0.85 SCN1A (0.36) SCN1ASCN8ASCN9A
SCHEMBL1668609 0.82 FPR2 (0.37) SCN1ASCN8ARORCNPY5RIDO1
SCHEMBL1668540 0.80 IDO1 (0.39) RORCNPY5RIDO1LMNAKMT2A
SCHEMBL1668410 0.79 KDM4E (0.49) RORCLMNAKMT2AGPR119CYP2C9
SCHEMBL1668891 0.79 GPR119 (0.48) RORCNPY5RIDO1LMNAKMT2A
SCHEMBL1669079 0.79 LMNA (0.38) RORCNPY5RIDO1LMNAKMT2A
SCHEMBL1668513 0.79 SCN1A (0.40) SCN1ASCN8ARORCENPP2NPY5R
SCHEMBL1668932 0.79 FPR2 (0.36) RORCNPY5RIDO1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8575168-B2 Compounds and compositions as modulators of GPR119 activity IRM LLC (BM) 2013-11-05 US claimed
EP-2486033-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2012-08-15 EP claimed
US-20110245220-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-10-06 US claimed
WO-2011044001-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-04-14 WO claimed
US-8575168-B2 Compounds and compositions as modulators of GPR119 activity IRM LLC (BM) 2013-11-05 US disclosed
US-8575168-B2 Compounds and compositions as modulators of GPR119 activity IRM LLC (BM) 2013-11-05 US disclosed
EP-2486033-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2012-08-15 EP disclosed
US-20110245220-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-10-06 US disclosed
WO-2011044001-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-04-14 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 (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-20110245220-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY GPR119, GPR65, GPR39 SCN1A 1500/4885SCN8A 2135/4885RORC 361/4885

“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.