SCHEMBL5057786

SCHEMBL5057786

O=C(O)c1csc(C2CCN(C(=O)Cc3ccccc3F)CC2)n1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.48
PPARG P37231 1/20 0.41
TP53 P04637 1/20 0.41
GAA P10253 1/20 0.41
UBE2M P61081 1/20 0.41
DCUN1D1 Q96GG9 1/20 0.41
C3AR1 Q16581 1/20 0.41
PTGER2 P43116 1/20 0.40
LMNA P02545 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
CASP8 Q14790 1/20 0.39

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
SCHEMBL5062062 0.87 ALDH1A1 (0.48) PPARGTP53UBE2MDCUN1D1LMNA
SCHEMBL27679675 0.83 LMNA (0.50) CNR1LMNAALOX15TSHRMAPK1
SCHEMBL5287621 0.81 TACR1 (0.54) LMNA
SCHEMBL1228585 0.79 FAAH (0.42) TP53UBE2MDCUN1D1PTGER2LMNA
SCHEMBL1043735 0.78 MEN1 (0.54) TP53GAALMNA
SCHEMBL13162592 0.78 EPHX2 (0.39) PPARGLMNAMAPK1CASP8
SCHEMBL9109184 0.78 SPR (0.44)
SCHEMBL5057785 0.77 CNR1 (0.36) CNR1PPARGTP53GAA
SCHEMBL2952296 0.76 CASP8 (0.42) TSHRCASP8
SCHEMBL5061924 0.76 ALDH1A1 (0.45) PPARGTP53LMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080306114-A1 Human G Protein-Coupled Receptor and Modulators Thereof for the Treatment of Hyperglycemia and Related Disorders ARENA PHARMACEUTICALS, INC (US) 2008-12-11 US disclosed
US-20070231263-A1 Human G protein-coupled receptor and modulators thereof for the treatment of hyperglycemia and related disorders ARENA PHARMACEUTICALS, INC. 2007-10-04 US disclosed
EP-1735622-A2 MODULATORS OF HUMAN G PROTEIN-COUPLED RECEPTORS FOR THE TREATMENT OF HYPERGLYCEMIA AND RELATED DISORDERS Arena Pharmaceuticals, Inc. (US) 2006-12-27 EP disclosed
WO-2005116653-A2 MODULATORS OF HUMAN G PROTEIN-COUPLED RECEPTORS FOR THE TREATMENT OF HYPERGLYCEMIA AND RELATED DISORDERS ARENA PHARMACEUTICALS, INC. (US) 2005-12-08 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-20070231263-A1 Human G protein-coupled receptor and modulators thereof for the treatment of hyperglycemia and related disorders GPR119, GCGR, GLP1R CNR1 90/4885PPARG 101/4885TP53 4042/4885
US-20080306114-A1 Human G Protein-Coupled Receptor and Modulators Thereof for the Treatment of Hyperglycemia and Related Disorders GPR119, GCGR, GLP1R CNR1 90/4885PPARG 101/4885TP53 4042/4885

“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.