SCHEMBL948474

SCHEMBL948474

CC(C)(C)OC(=O)N1CCC(N2Cc3cncn3C2=O)CC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45
THRB P10828 1/20 0.45
TP53 P04637 1/20 0.44
GPR119 Q8TDV5 10/20 0.44
CTSD P07339 1/20 0.43
CTSE P14091 1/20 0.43
BACE1 P56817 1/20 0.43
HCAR1 Q9BXC0 1/20 0.42
FPR2 P25090 1/20 0.42
HPGD P15428 1/20 0.41
DDB1 Q16531 1/20 0.41
CRBN Q96SW2 1/20 0.41

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
SCHEMBL948392 0.90 KDM4E (0.44) KDM4EMAPTTHRBTP53GPR119
SCHEMBL947287 0.76 GPR119 (0.53) KDM4EMAPTTHRBTP53GPR119
SCHEMBL949939 0.76 GPR119 (0.44) KDM4EMAPTTHRBTP53GPR119
SCHEMBL947633 0.76 F10 (0.50) KDM4EMAPTTHRBTP53GPR119
SCHEMBL948092 0.76 TP53 (0.44) KDM4EMAPTTHRBTP53GPR119
SCHEMBL948876 0.75 HCAR1 (0.41) KDM4EMAPTTHRBTP53GPR119
SCHEMBL948889 0.75 TP53 (0.43) KDM4EMAPTTHRBTP53GPR119
SCHEMBL948476 0.75 GPR119 (0.48) KDM4EMAPTTHRBTP53GPR119
SCHEMBL952015 0.73 TP53 (0.45) KDM4EMAPTTHRBTP53GPR119
SCHEMBL950492 0.72 TP53 (0.40) KDM4EMAPTTHRBTP53GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-13 US disclosed
US-20070004736-A1 Imidazole derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-04 US disclosed
EP-1564213-A1 IMIDAZOLE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2005-08-17 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 (2 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-20070004736-A1 Imidazole derivative, process for producing the same, and use HRH4, F2, HRH2 KDM4E 1356/4885MAPT 4771/4885THRB 615/4885
US-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE F2, H1-3, CYC1 KDM4E 1558/4885MAPT 4800/4885THRB 604/4885

“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.