SCHEMBL948092

SCHEMBL948092

CCc1ncc2n1C(=O)N(C1CCN(C(=O)OC(C)(C)C)CC1)C2

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
F10 P00742 3/20 0.42
F2 P00734 2/20 0.42
HCAR1 Q9BXC0 1/20 0.42
GPR119 Q8TDV5 7/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
FPR2 P25090 1/20 0.39
NR3C1 P04150 1/20 0.39
HPGD P15428 1/20 0.39
CTSD P07339 1/20 0.39
CTSE P14091 1/20 0.39
BACE1 P56817 1/20 0.39
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38

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
SCHEMBL947633 0.92 F10 (0.50) TP53F10F2HCAR1GPR119
SCHEMBL948889 0.91 TP53 (0.43) TP53F10F2HCAR1GPR119
SCHEMBL950492 0.86 TP53 (0.40) TP53F10F2HCAR1GPR119
SCHEMBL949939 0.83 GPR119 (0.44) TP53HCAR1GPR119KDM4EMAPT
SCHEMBL948876 0.82 HCAR1 (0.41) TP53HCAR1GPR119KDM4EMAPT
SCHEMBL948621 0.82 EPHX1 (0.48) TP53F10F2HCAR1GPR119
SCHEMBL948472 0.81 F10 (0.38) TP53F10F2HCAR1GPR119
SCHEMBL948435 0.81 F2 (0.37) TP53F10F2HCAR1GPR119
SCHEMBL948437 0.81 L3MBTL1 (0.41) TP53F10F2GPR119MAPT
SCHEMBL949039 0.81 F10 (0.38) TP53F10F2HCAR1GPR119

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 TP53 4661/4885F10 545/4885F2 2/4885
US-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE F2, H1-3, CYC1 TP53 4591/4885F10 490/4885F2 1/4885

“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.