SCHEMBL288648

SCHEMBL288648

Cc1c(Cl)ncnc1O[C@H]1CCN(C(=O)O)C[C@H]1F

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 4/20 0.39
TBK1 Q9UHD2 4/20 0.35
GPR119 Q8TDV5 8/20 0.34
NTRK1 P04629 4/20 0.33
KCNH2 Q12809 4/20 0.33
JAK2 O60674 2/20 0.33
ADRA1A P35348 1/20 0.33
NTRK3 Q16288 1/20 0.33
NTRK2 Q16620 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL1768128 1.00 PIK3CD (0.39) PIK3CDTBK1GPR119NTRK1KCNH2
SCHEMBL298803 1.00 PIK3CD (0.39) PIK3CDTBK1GPR119NTRK1KCNH2
SCHEMBL761206 0.86 PIK3CD (0.47) PIK3CDTBK1GPR119
SCHEMBL13836529 0.86 PIK3CD (0.47) PIK3CDTBK1GPR119
SCHEMBL10170824 0.84 GPR119 (0.42) PIK3CDGPR119CYP2C9
SCHEMBL1768452 0.84 GPR119 (0.42) PIK3CDGPR119CYP2C9
SCHEMBL1768451 0.84 GPR119 (0.42) PIK3CDGPR119CYP2C9
SCHEMBL288925 0.81 GPR119 (0.46) PIK3CDGPR119CYP2C9
SCHEMBL14639244 0.79 GPR119 (0.58) GPR119
SCHEMBL14637820 0.79 GPR119 (0.58) GPR119

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-20120295845-A1 IMIDAZO-PYRAZOLES AS GPR119 INHIBITORS PFIZER INC 2012-11-22 US disclosed
EP-2504342-A1 IMIDAZO-PYRAZOLES AS GPR119 INHIBITORS Pfizer Inc. (US) 2012-10-03 EP disclosed
EP-2427450-A1 GPR 119 MODULATORS Pfizer Inc. (US) 2012-03-14 EP disclosed
EP-2427448-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-2011061679-A1 IMIDAZO-PYRAZOLES AS GPR119 INHIBITORS PFIZER INC. (US) 2011-05-26 WO disclosed
WO-2010128414-A1 GPR 119 MODULATORS PFIZER INC. (US) 2010-11-11 WO 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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 PIK3CD 2858/4885TBK1 3342/4885GPR119 1/4885
US-20100285145-A1 GPR 119 MODULATORS GPR119, GPR65, GPR39 PIK3CD 2502/4885TBK1 3009/4885GPR119 1/4885
US-20120295845-A1 IMIDAZO-PYRAZOLES AS GPR119 INHIBITORS GPR3, GPR119, GPR84 PIK3CD 2596/4885TBK1 4249/4885GPR119 2/4885

“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.