SCHEMBL10183293

SCHEMBL10183293

CC(C)OC(=O)N1CC(n2cnc3cnc(C(C)(C)C)cc32)C1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAP3K12 Q12852 1/20 0.36
IDO1 P14902 10/20 0.36
GPR119 Q8TDV5 4/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 2/20 0.33
HPGD P15428 2/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL10183168 0.87 HCAR1 (0.40) IDO1GPR119PSEN1PSEN2APH1B
SCHEMBL10183285 0.86 ALDH1A1 (0.46) IDO1PSEN1PSEN2APH1BNCSTN
SCHEMBL10183257 0.84 IDO1 (0.37) IDO1ALDH1A1GAA
SCHEMBL10234149 0.83 ALDH1A1 (0.37) MAP3K12IDO1GPR119PSEN1PSEN2
SCHEMBL10183166 0.80 HCAR1 (0.47) GPR119
SCHEMBL10183244 0.79 IDO1 (0.35) IDO1ALDH1A1MEN1HPGDKMT2A
SCHEMBL10183230 0.77 GLRA3 (0.35) IDO1GAA
SCHEMBL10183263 0.77 GLRA3 (0.41) IDO1ALDH1A1MEN1HPGDKMT2A
SCHEMBL10183626 0.76 EGFR (0.40) IDO1ALDH1A1HPGDGAA
SCHEMBL10183159 0.74 JAK1 (0.35) IDO1

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-20120040951-A1 HETEROARYL COMPOUNDS USEFUL AS RAF KINASE INHIBITORS SUNESIS PHARMACEUTICALS, INC. 2012-02-16 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-20120040951-A1 HETEROARYL COMPOUNDS USEFUL AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF MAP3K12 39/4885IDO1 3440/4885GPR119 2713/4885

“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.