SCHEMBL24007166

SCHEMBL24007166

CC(C)(C)OC(=O)Nc1cc(Br)cn(C2CC[C@H]2O)c1=O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 5/20 0.36
CNR2 P34972 1/20 0.35
BACE1 P56817 3/20 0.33
IDO1 P14902 2/20 0.33
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
P2RX7 Q99572 1/20 0.32
BCL2 P10415 2/20 0.32
BECN1 Q14457 2/20 0.32
LCK P06239 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
OGFRL1 Q5TC84 1/20 0.31
GAA P10253 1/20 0.31
LMNA P02545 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL25753205 1.00 AAK1 (0.36) AAK1CNR2BACE1IDO1NFKB1
SCHEMBL24007994 1.00 AAK1 (0.36) AAK1CNR2BACE1IDO1NFKB1
SCHEMBL24007161 0.85 CNR2 (0.35) AAK1CNR2NFKB1NFKB2RELA
SCHEMBL26008629 0.85 CNR2 (0.35) AAK1CNR2NFKB1NFKB2RELA
SCHEMBL24007995 0.85 CNR2 (0.35) AAK1CNR2NFKB1NFKB2RELA
SCHEMBL26008645 0.85 CNR2 (0.35) AAK1CNR2NFKB1NFKB2RELA
SCHEMBL24007614 0.83 CHRM2 (0.37) AAK1CNR2BACE1IDO1NFKB1
SCHEMBL21246032 0.79 TYK2 (0.41)
SCHEMBL21227583 0.79 TYK2 (0.41)
SCHEMBL20689309 0.79 TYK2 (0.41)

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-20230265075-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. 2023-08-24 US disclosed
US-11691963-B2 6-heteroaryloxy benzimidazoles and azabenzimidazoles as JAK2 inhibitors AJAX THERAPEUTICS, INC. (US) 2023-07-04 US disclosed
WO-2021226261-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. (US) 2021-11-11 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 (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-20230265075-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS JAK2, JAK3, STAT5B AAK1 904/4885CNR2 3981/4885BACE1 4884/4885
US-11691963-B2 6-heteroaryloxy benzimidazoles and azabenzimidazoles as JAK2 inhibitors JAK2, JAK3, STAT5B AAK1 904/4885CNR2 3981/4885BACE1 4884/4885

“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.