SCHEMBL4694655

SCHEMBL4694655

CCOC(=O)c1cn2c(nc3cc(CN(CC4CCCO4)C(=O)OC(C)(C)C)ccc32)s1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CNR2 P34972 2/20 0.38
POLB P06746 1/20 0.38
TP53 P04637 2/20 0.37
MAPT P10636 1/20 0.37
TSHR P16473 2/20 0.37
ALDH1A1 P00352 1/20 0.37
GRM1 Q13255 3/20 0.37
GAA P10253 1/20 0.36
FEN1 P39748 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL4694653 0.94 GRM1 (0.43) MEN1KMT2APOLBTP53MAPT
SCHEMBL4689303 0.91 MEN1 (0.40) MEN1KMT2ACNR2POLBTP53
SCHEMBL4691279 0.87 GRM1 (0.38) MEN1KMT2ACNR2POLBTP53
SCHEMBL4692246 0.85 GRM1 (0.39) MEN1KMT2ACNR2TP53MAPT
SCHEMBL4692988 0.85 GRM1 (0.41) MEN1KMT2ACNR2TP53MAPT
SCHEMBL4689299 0.85 GRM1 (0.45) MEN1KMT2APOLBTP53MAPT
SCHEMBL5542947 0.84 GRM1 (0.36) MEN1KMT2ACNR2POLBTP53
SCHEMBL4691975 0.84 GRM1 (0.36) MEN1KMT2ACNR2POLBMAPT
SCHEMBL4693608 0.84 GRM1 (0.46) MEN1KMT2ATP53MAPTALDH1A1
SCHEMBL4691276 0.81 GRM1 (0.44) MEN1KMT2APOLBTP53MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1486501-B1 AMINOMETHYL-SUBSTITUTED THIAZOLOBENZIMIDAZOLE DERIVATIVE ASTELLAS PHARMA INC (JP) 2008-09-10 EP disclosed
US-7250429-B2 Aminomethyl-substituted thiazolobenzimidazole compounds ASTELLAS PHARMA INC. (JP) 2007-07-31 US disclosed
US-20050148642-A1 Aminomethyl-substituted thiazolobenzimidazole derivative ASTELLAS PHARMA INC. (JP) 2005-07-07 US disclosed
EP-1486501-A1 AMINOMETHYL-SUBSTITUTED THIAZOLOBENZIMIDAZOLE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2004-12-15 EP 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-20050148642-A1 Aminomethyl-substituted thiazolobenzimidazole derivative GRM1, GRIN1, GRM3 MEN1 2545/4885KMT2A 832/4885CNR2 306/4885

“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.