SCHEMBL5654514

SCHEMBL5654514

CNS(=O)(=O)c1cc(-c2cc(C=C3SC(=O)NC3=O)ccc2OC(F)(F)F)c2c(c1)C(C)(C)CO2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.49
SCN9A Q15858 1/20 0.47
PIM1 P11309 5/20 0.43
PIM2 Q9P1W9 5/20 0.43
GSK3B P49841 1/20 0.40
PDE4B Q07343 1/20 0.40
PIM3 Q86V86 1/20 0.40
ESRRA P11474 6/20 0.39
TTR P02766 1/20 0.39
CISD1 Q9NZ45 1/20 0.39
CYP3A4 P08684 3/20 0.38
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
PTPN1 P18031 1/20 0.37
HPGD P15428 1/20 0.37
IGF1R P08069 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL5656108 1.00 RXRA (0.49) RXRASCN9APIM1PIM2GSK3B
SCHEMBL14572381 1.00 RXRA (0.49) RXRASCN9APIM1PIM2GSK3B
SCHEMBL14572382 0.91 RXRA (0.51) RXRASCN9APIM1PIM2GSK3B
SCHEMBL5655695 0.91 RXRA (0.51) RXRASCN9APIM1PIM2GSK3B
SCHEMBL5655691 0.91 RXRA (0.51) RXRASCN9APIM1PIM2GSK3B
SCHEMBL5654312 0.85 TNNI3K (0.36) RXRA
SCHEMBL14572370 0.84 RXRA (0.49) RXRASCN9APIM1PIM2GSK3B
SCHEMBL5658666 0.84 RXRA (0.49) RXRASCN9APIM1PIM2GSK3B
SCHEMBL5658665 0.84 RXRA (0.49) RXRASCN9APIM1PIM2GSK3B
SCHEMBL5658187 0.83 ESRRA (0.50) RXRASCN9APIM1PIM2GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7196108-B2 Bicyclic heterocycles for the treatment of diabetes and other diseases INCYTE SAN DIEGO INC. (US) 2007-03-27 US claimed
EP-1487446-A4 BICYCLIC HETEROCYCLES FOR THE TREATMENT OF DIABETES AND OTHER DISEASES INCYTE SAN DIEGO INC (US) 2006-04-19 EP claimed
EP-1487446-A2 BICYCLIC HETEROCYCLES FOR THE TREATMENT OF DIABETES AND OTHER DISEASES Incyte San Diego, Inc. (US) 2004-12-22 EP claimed
US-20040034004-A1 Bicyclic heterocycles for the treatment of diabetes and other diseases ORTHO MCNEIL PHARMACEUTICAL INC. 2004-02-19 US claimed
WO-2003075858-A2 BICYCLIC HETEROCYCLES FOR THE TREATMENT OF DIABETES AND OTHER DISEASES INCYTE SAN DIEGO INCORPORATED (US) 2003-09-18 WO claimed
US-7196108-B2 Bicyclic heterocycles for the treatment of diabetes and other diseases INCYTE SAN DIEGO INC. (US) 2007-03-27 US disclosed
EP-1487446-A4 BICYCLIC HETEROCYCLES FOR THE TREATMENT OF DIABETES AND OTHER DISEASES INCYTE SAN DIEGO INC (US) 2006-04-19 EP disclosed
EP-1487446-A2 BICYCLIC HETEROCYCLES FOR THE TREATMENT OF DIABETES AND OTHER DISEASES Incyte San Diego, Inc. (US) 2004-12-22 EP disclosed
US-20040034004-A1 Bicyclic heterocycles for the treatment of diabetes and other diseases ORTHO MCNEIL PHARMACEUTICAL INC. 2004-02-19 US disclosed
WO-2003075858-A2 BICYCLIC HETEROCYCLES FOR THE TREATMENT OF DIABETES AND OTHER DISEASES INCYTE SAN DIEGO INCORPORATED (US) 2003-09-18 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-20040034004-A1 Bicyclic heterocycles for the treatment of diabetes and other diseases PC, CYP27A1, GPR119 RXRA 1262/4885SCN9A 4099/4885PIM1 2592/4885

“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.