SCHEMBL312673

SCHEMBL312673

CC(NC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C(=O)c1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.49
KMT2A Q03164 2/20 0.48
STS P08842 7/20 0.47
PTPN2 P17706 1/20 0.46
PTPN1 P18031 1/20 0.46
PTPN6 P29350 1/20 0.46
ABL1 P00519 1/20 0.46
RIN1 Q13671 1/20 0.46
GPR119 Q8TDV5 5/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
MEN1 O00255 1/20 0.42
SFRP1 Q8N474 1/20 0.42

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
SCHEMBL15732635 0.87 STS (0.49) KMT2ASTSPTPN2PTPN1PTPN6
SCHEMBL15732630 0.85 KMT2A (0.54) EPHX2KMT2ASTSPTPN2PTPN1
SCHEMBL15732475 0.83 STS (0.55) EPHX2KMT2ASTSPTPN2PTPN1
SCHEMBL15732679 0.83 GPR119 (0.52) EPHX2KMT2ASTSPTPN2PTPN1
SCHEMBL2063004 0.82 EPHX2 (0.57) EPHX2KMT2ASTSPTPN2PTPN1
SCHEMBL22305301 0.79 TRPA1 (0.50)
SCHEMBL28618868 0.79 TRPA1 (0.50)
SCHEMBL311398 0.74 EPHX2 (0.57) EPHX2KMT2ASTSPTPN2PTPN1
SCHEMBL22288577 0.73 CHRNA1 (0.50)
SCHEMBL22288575 0.73 CHRNA1 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2148880-B1 P70 S6 KINASE INHIBITORS LILLY CO ELI (US) 2014-05-28 EP disclosed
US-20120071490-A1 P70 S6 KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2012-03-22 US disclosed
US-8093383-B2 P70 S6 kinase inhibitors ELI LILLY AND COMPANY (US) 2012-01-10 US disclosed
US-20090163714-A1 P70 S6 KINASE INHIBITORS ELI LILLY AND COMPANY 2009-06-25 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 (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-20090163714-A1 P70 S6 KINASE INHIBITORS RPS6KA6, RPS6KA1, RPS6KA2 EPHX2 4803/4885KMT2A 3302/4885STS 3776/4885
US-20120071490-A1 P70 S6 KINASE INHIBITORS RPS6KA6, RPS6KA1, RPS6KA2 EPHX2 4803/4885KMT2A 3302/4885STS 3776/4885

“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.