SCHEMBL288817

SCHEMBL288817

Cc1c(OC2C3CNCC2COC3)ncnc1N1CCc2ncccc21

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.41
PTPN11 Q06124 4/20 0.33
PDE10A Q9Y233 3/20 0.31
KCNH2 Q12809 1/20 0.30

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
SCHEMBL759311 1.00 GPR119 (0.41) GPR119PTPN11PDE10AKCNH2
SCHEMBL759512 0.85 GPR119 (0.50) GPR119
SCHEMBL10170988 0.83 GPR119 (0.64) GPR119
SCHEMBL10170980 0.82 GPR119 (0.51) GPR119
SCHEMBL10170992 0.81 GPR119 (0.56) GPR119
SCHEMBL10171003 0.80 GPR119 (0.53) GPR119
SCHEMBL10170995 0.79 GPR119 (0.49) GPR119
SCHEMBL299903 0.77 SSTR4 (0.33) GPR119PTPN11KCNH2
SCHEMBL760625 0.77 SSTR4 (0.33) GPR119PTPN11KCNH2
SCHEMBL760626 0.77 SSTR4 (0.33) GPR119PTPN11KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427450-A1 GPR 119 MODULATORS Pfizer Inc. (US) 2012-03-14 EP disclosed
US-20120052130-A1 GPR 119 MODULATORS PFIZER INC. 2012-03-01 US disclosed
WO-2010128425-A1 GPR 119 MODULATORS PFIZER INC. (US) 2010-11-11 WO disclosed
US-20100285145-A1 GPR 119 MODULATORS PFIZER INC 2010-11-11 US disclosed
US-20100285145-A1 GPR 119 MODULATORS PFIZER INC 2010-11-11 US 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-20120052130-A1 GPR 119 MODULATORS GPR119, GPR39, GPR65 GPR119 1/4885PTPN11 3011/4885PDE10A 1058/4885
US-20100285145-A1 GPR 119 MODULATORS GPR119, GPR65, GPR39 GPR119 1/4885PTPN11 3335/4885PDE10A 928/4885

“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.