SCHEMBL10329947

SCHEMBL10329947

Cc1cc(NC(=O)OC(C)(C)C)c(C(=O)OC(C)(C)C)c(C)n1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
LCK P06239 6/20 0.40
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
BRD9 Q9H8M2 1/20 0.38
CISD2 Q8N5K1 1/20 0.38
ALDH1A1 P00352 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ATR Q13535 1/20 0.36
ALOX15 P16050 1/20 0.35
TLR9 Q9NR96 1/20 0.35
TLR8 Q9NR97 1/20 0.35
TLR7 Q9NYK1 1/20 0.35

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
SCHEMBL12931843 0.86 SMN1; SMN2 (0.45) SMN1; SMN2LCKMEN1HTTKMT2A
SCHEMBL10330551 0.77 ATR (0.47) LCKBRD9CISD2ATR
SCHEMBL1057673 0.77 ATR (0.44) LCKBRD9CISD2CYP2C9CYP2C19
SCHEMBL31664072 0.77 ATR (0.44) LCKBRD9CISD2CYP2C9CYP2C19
SCHEMBL20911612 0.76 LCK (0.38) LCKBRD9CISD2ATR
SCHEMBL25878585 0.76 KMT2A (0.45) SMN1; SMN2LCKHTTKMT2AALDH1A1
SCHEMBL10330552 0.74 ATR (0.41) LCKMEN1HTTKMT2ABRD9
SCHEMBL21871197 0.73 CA12 (0.46) LCK
SCHEMBL25136736 0.73 ATR (0.40) SMN1; SMN2LCKMEN1HTTKMT2A
SCHEMBL9709748 0.73 KMT2A (0.56) SMN1; SMN2LCKMEN1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8722692-B2 Compounds and compositions as Syk kinase inhibitors IRM LLC (BM) 2014-05-13 US disclosed
US-20120184526-A1 COMPOUNDS AND COMPOSITIONS AS SYK KINASE INHIBITORS IRM LLC (BM) 2012-07-19 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-20120184526-A1 COMPOUNDS AND COMPOSITIONS AS SYK KINASE INHIBITORS SYK, BTK, LYN SMN1; SMN2 3577/4885LCK 4/4885MEN1 4339/4885

“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.