SCHEMBL4793644

SCHEMBL4793644

Cc1nc(Oc2ccccc2)c2nc(C)n(CCO)c2c1C

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
LMNA P02545 2/20 0.34
HTT P42858 2/20 0.34
TSHR P16473 2/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 3/20 0.33
P2RX3 P56373 2/20 0.32
MEN1 O00255 1/20 0.32
DHODH Q02127 1/20 0.32
HRH4 Q9H3N8 1/20 0.32
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
RPS6KA5 O75582 1/20 0.31

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
SCHEMBL4793912 0.89 SLC18A3 (0.35) ALDH1A1LMNAHTTTSHRTP53
SCHEMBL4795253 0.86 ALDH1A1 (0.51) ALDH1A1LMNAHTTTSHRTP53
SCHEMBL4792276 0.85 LMNA (0.35) ALDH1A1LMNAHTTTP53CYP1A2
SCHEMBL6094271 0.84 PIM1 (0.40) ALDH1A1LMNAHTTTP53CYP1A2
SCHEMBL5337848 0.84 SLC18A3 (0.37) ALDH1A1LMNAHTTTP53CYP1A2
SCHEMBL4793826 0.83 LMNA (0.39) ALDH1A1LMNAHTTTSHRTP53
SCHEMBL4791598 0.82 ALDH1A1 (0.37) ALDH1A1LMNAHTTTSHRTP53
SCHEMBL4793497 0.82 LMNA (0.36) ALDH1A1LMNAHTTTP53CYP1A2
SCHEMBL4793186 0.80 LMNA (0.37) ALDH1A1LMNAHTTTP53CYP1A2
SCHEMBL6726135 0.79 LMNA (0.34) ALDH1A1LMNAHTTTP53

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
EP-1513524-A4 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES CO (US) 2008-09-03 EP disclosed
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
US-7125890-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-10-24 US disclosed
EP-1513524-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M Innovative Properties Company (US) 2005-03-16 EP disclosed
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors 3M INNOVATIVE PROPERTIES COMPANY 2005-02-10 US disclosed
US-6797718-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-09-28 US disclosed
US-20040010007-A1 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-01-15 US disclosed
WO-2003103584-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-12-18 WO 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-20060252792-A1 ETHER SUBSTITUTED IMIDAZOPYRIDINES IL2, IL4, MYD88 ALDH1A1 1803/4885LMNA 4400/4885HTT 4588/4885
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors IL2, IFNG, TSLP ALDH1A1 940/4885LMNA 4818/4885HTT 4440/4885
US-20040010007-A1 Ether substituted imidazopyridines IL2, IL4, MYD88 ALDH1A1 1803/4885LMNA 4400/4885HTT 4588/4885

“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.