SCHEMBL31428465

SCHEMBL31428465

CC(C)(C)OC(=O)N(Cc1ccc2nc(C=O)cc(-c3ccc(-c4ccccc4)cc3)c2c1)C1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.39
EZH2 Q15910 2/20 0.36
HSD11B1 P28845 1/20 0.35
NR1H4 Q96RI1 1/20 0.34
HDAC1 Q13547 1/20 0.33
SLC6A2 P23975 4/20 0.33
SLC6A4 P31645 4/20 0.33
SLC6A3 Q01959 4/20 0.33
CYP2D6 P10635 3/20 0.33
LTB4R2 Q9NPC1 1/20 0.33
CFTR P13569 1/20 0.32
CHRM3 P20309 1/20 0.32
KCNH2 Q12809 1/20 0.32
ACACB O00763 2/20 0.32
ACACA Q13085 1/20 0.32
GPR119 Q8TDV5 1/20 0.32

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
SCHEMBL31428746 0.95 GRM2 (0.35) GRM2EZH2HSD11B1NR1H4HDAC1
SCHEMBL24975804 0.95 GRM2 (0.35) GRM2EZH2HSD11B1NR1H4HDAC1
SCHEMBL31428558 0.94 GRM2 (0.35) GRM2EZH2HSD11B1NR1H4SLC6A2
SCHEMBL24975810 0.94 GRM2 (0.35) GRM2EZH2HSD11B1NR1H4SLC6A2
SCHEMBL24975808 0.93 SLC6A2 (0.39) GRM2EZH2HSD11B1NR1H4SLC6A2
SCHEMBL31428517 0.89 GRM2 (0.39) GRM2EZH2HSD11B1NR1H4HDAC1
SCHEMBL31428920 0.88 GRM2 (0.38) GRM2KCNH2
SCHEMBL24975439 0.87 IRAK1 (0.36) GRM2
SCHEMBL31428821 0.87 IRAK1 (0.36) GRM2
SCHEMBL31428539 0.86 GRM2 (0.35) GRM2NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2025-03-20 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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND BRAF, RAF1, NRAS GRM2 4454/4885EZH2 1692/4885HSD11B1 3183/4885

“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.