SCHEMBL5344816

SCHEMBL5344816

Cc1nc(Oc2ccccc2)c2nc(C)n(CCOCC#Cc3ccccc3)c2c1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
HTR2A P28223 4/20 0.34
HTR2C P28335 4/20 0.34
HTR2B P41595 4/20 0.34
SIGMAR1 Q99720 4/20 0.34
DRD2 P14416 2/20 0.34
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
HTT P42858 1/20 0.33
MEN1 O00255 1/20 0.31
TSHR P16473 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP1A2 P05177 2/20 0.30
CYP2C19 P33261 2/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CDK9 P50750 1/20 0.30
DYRK1A Q13627 1/20 0.30
DYRK2 Q92630 1/20 0.30
USP2 O75604 1/20 0.30
CYP3A4 P08684 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
SCHEMBL4792152 0.85 TLR7 (0.38) ALDH1A1HTR2AHTR2CHTR2BSIGMAR1
SCHEMBL4795253 0.84 ALDH1A1 (0.51) ALDH1A1LMNATP53HTTTSHR
SCHEMBL4791598 0.82 ALDH1A1 (0.37) ALDH1A1LMNATP53HTTMEN1
SCHEMBL4793644 0.78 ALDH1A1 (0.35) ALDH1A1LMNATP53HTTMEN1
SCHEMBL4793191 0.77 TLR7 (0.40) ALDH1A1CDK9DYRK1ADYRK2
SCHEMBL5337848 0.77 SLC18A3 (0.37) ALDH1A1LMNATP53HTTMEN1
SCHEMBL4792276 0.76 LMNA (0.35) ALDH1A1LMNATP53HTTMEN1
SCHEMBL6094271 0.76 PIM1 (0.40) ALDH1A1LMNATP53HTTCYP1A2
SCHEMBL4793826 0.75 LMNA (0.39) ALDH1A1LMNATP53HTTMEN1
SCHEMBL4794435 0.74 CHRNA7 (0.35) CYP3A4

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-7220758-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-22 US disclosed
US-20060252792-A1 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2006-11-09 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-20060252792-A1 ETHER SUBSTITUTED IMIDAZOPYRIDINES IL2, IL4, MYD88 ALDH1A1 1803/4885HTR2A 4759/4885HTR2C 4186/4885

“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.