SCHEMBL4358196

SCHEMBL4358196

Cc1ncccc1Nc1ncnc2c1cnn2C1CCN(C(=O)O)CC1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.51
CYP2C9 P11712 1/20 0.51
GPR119 Q8TDV5 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.42
HSD17B10 Q99714 2/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
TP53 P04637 2/20 0.41
MAPK14 Q16539 7/20 0.40
ABL1 P00519 1/20 0.40
BCR P11274 1/20 0.40
MAPT P10636 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL1128742 0.87 CYP3A4 (0.68) CYP3A4CYP2C9GPR119SMN1; SMN2HSD17B10
SCHEMBL4362383 0.85 CYP2C9 (0.55) CYP3A4CYP2C9GPR119
SCHEMBL27852879 0.83 CYP3A4 (0.43) CYP3A4CYP2C9GPR119SMN1; SMN2HSD17B10
SCHEMBL4355645 0.82 CYP2C9 (0.46) CYP3A4CYP2C9GPR119SMN1; SMN2HSD17B10
SCHEMBL1128538 0.82 CYP3A4 (0.53) CYP3A4GPR119
SCHEMBL4352336 0.79 CYP3A4 (0.79) CYP3A4CYP2C9GPR119
SCHEMBL1449681 0.76 GPR119 (0.45) CYP2C9GPR119SMN1; SMN2ALDH1A1
SCHEMBL1449951 0.74 GPR119 (0.44) CYP2C9GPR119HSD17B10ALDH1A1
SCHEMBL1450077 0.74 GPR119 (0.44) CYP2C9GPR119SMN1; SMN2HSD17B10ALDH1A1
SCHEMBL1128392 0.74 CYP2C9 (0.72) CYP3A4CYP2C9GPR119

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
US-8188098-B2 GPR119 receptor agonists HOFFMANN-LA ROCHE INC. (US) 2012-05-29 US disclosed
US-20090286812-A1 GPR119 Receptor Agonists ERICKSON SHAWN DAVID 2009-11-19 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-20090286812-A1 GPR119 Receptor Agonists GPR119, GPR27, GPR139 CYP3A4 1503/4885CYP2C9 917/4885GPR119 1/4885

“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.