SCHEMBL4358055

SCHEMBL4358055

c1nc(Oc2ccc(-n3cncn3)cc2)c2cnn(C3CCNCC3)c2n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.48
GPR119 Q8TDV5 2/20 0.42
ABL1 P00519 1/20 0.39
BCR P11274 1/20 0.39
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
LCK P06239 2/20 0.36
SRC P12931 2/20 0.36
TEK Q02763 1/20 0.36
ICAM1 P05362 1/20 0.35
SELE P16581 1/20 0.35
VCAM1 P19320 1/20 0.35
FLT3 P36888 2/20 0.34
PDE9A O76083 1/20 0.34
MAPK10 P53779 1/20 0.33
PPARD Q03181 1/20 0.33
PCSK9 Q8NBP7 1/20 0.32
SLC2A1 P11166 1/20 0.32

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
SCHEMBL4358365 0.82 ABL1 (0.57) CYP3A4ABL1BCRLCKSRC
SCHEMBL1128431 0.82 CYP3A4 (0.73) CYP3A4GPR119CYP2C9
SCHEMBL2016396 0.80 CYP3A4 (0.57) CYP3A4GPR119CYP2C9
SCHEMBL4358053 0.79 TSHR (0.55) CYP3A4FLT3TP53POLB
SCHEMBL4355586 0.79 CYP3A4 (0.46) CYP3A4ABL1BCRCYP1A2CYP2C9
SCHEMBL1128588 0.79 CYP3A4 (0.70) CYP3A4GPR119CYP2C9FLT3
SCHEMBL2020220 0.78 CYP3A4 (0.60) CYP3A4GPR119CYP2C9SRC
SCHEMBL4354679 0.77 CYP3A4 (0.57) CYP3A4GPR119ABL1BCRCYP2C9
SCHEMBL4357333 0.74 CYP3A4 (0.42) CYP3A4ABL1BCRLCKSRC
SCHEMBL4358920 0.74 BRAF (0.51) CYP3A4ABL1BCRFLT3

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 1503/4885GPR119 1/4885ABL1 2653/4885

“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.