SCHEMBL1448593

SCHEMBL1448593

CN(CCO)C(=O)c1ccc(COc2cnc(N3CCN(c4ncc(F)cn4)CC3)nc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.45
KIT P10721 1/20 0.43
ALKBH1 Q13686 1/20 0.43
MMP13 P45452 1/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
SLC6A7 Q99884 1/20 0.41
GYS1 P13807 1/20 0.40
CYP11B2 P19099 1/20 0.39
MAOB P27338 1/20 0.39
KDM1A O60341 1/20 0.39
HDAC6 Q9UBN7 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
SCHEMBL1448290 0.85 GPR119 (0.67) GPR119
SCHEMBL1447885 0.77 GPR119 (0.67) GPR119
SCHEMBL1447763 0.74 GPR119 (0.70) GPR119
SCHEMBL1447762 0.74 GPR119 (0.70) GPR119
SCHEMBL1448399 0.74 GPR119 (0.67) GPR119KITMMP13
SCHEMBL1449656 0.72 GPR119 (0.47) GPR119KMT2AMEN1SLC6A7
SCHEMBL28283417 0.69 MCHR1 (0.56) KMT2AHDAC6
SCHEMBL15578131 0.68 ALKBH1 (0.53) GPR119KITALKBH1MMP13KMT2A
SCHEMBL10795881 0.67 HDAC4 (0.54) CYP11B2HDAC6
SCHEMBL1448573 0.67 GPR119 (0.62) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011030139-A1 4- (PYRIMIDIN-2-YL) -PIPERAZINE AND 4- (PYRIMIDIN-2-YL) -PIPERIDINE DERIVATIVES AS GPR119 MODULATORS ASTRAZENECA AB (SE) 2011-03-17 WO disclosed
US-20110065706-A1 Therapeutic Agents 812 ASTRAZENECA AB (SE) 2011-03-17 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 (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-20110065706-A1 Therapeutic Agents 812 GPR119, GPR84, GPR132 GPR119 1/4885KIT 1215/4885ALKBH1 4637/4885

“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.