SCHEMBL2365874

SCHEMBL2365874

COCC1COC(=O)N1c1ccc(C(=O)N2CCN(c3ncc(C4CC4)cc3C)CC2)c(N2CCCS2(=O)=O)c1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.35
PIK3C3 Q8NEB9 1/20 0.32
SLC6A9 P48067 1/20 0.31
SLC6A5 Q9Y345 1/20 0.31
IDH1 O75874 4/20 0.31
TP53 P04637 2/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
THRB P10828 1/20 0.30
OXTR P30559 2/20 0.30

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
SCHEMBL2365865 1.00 PIK3CA (0.35) PIK3CAPIK3C3SLC6A9SLC6A5IDH1
SCHEMBL2366433 0.93 TP53 (0.32) PIK3C3SLC6A9SLC6A5IDH1TP53
SCHEMBL2366426 0.93 TP53 (0.32) PIK3C3SLC6A9SLC6A5IDH1TP53
SCHEMBL2366020 0.93 P2RX3 (0.33) PIK3C3SLC6A9SLC6A5IDH1TP53
SCHEMBL2366012 0.93 P2RX3 (0.33) PIK3C3SLC6A9SLC6A5IDH1TP53
SCHEMBL2365885 0.92 PIK3CA (0.35) PIK3CAPIK3C3SLC6A9SLC6A5IDH1
SCHEMBL2365877 0.92 PIK3CA (0.35) PIK3CAPIK3C3SLC6A9SLC6A5IDH1
SCHEMBL2366290 0.91 P2RY12 (0.33) TP53LMNAMAPTTHRB
SCHEMBL2366294 0.91 P2RY12 (0.33) TP53LMNAMAPTTHRB
SCHEMBL2366804 0.90 PIK3CA (0.34) PIK3CAPIK3C3SLC6A9SLC6A5TP53

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-2364975-B1 NOVEL AMIDE DERIVATIVE AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORP (JP) 2013-06-12 EP disclosed
US-8354401-B2 Oxazolidinone amide aromatic compounds for supressing MMP-9 production MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-01-15 US disclosed
US-20110263571-A1 NOVEL AMIDE DERIVATIVE AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-10-27 US disclosed
EP-2364975-A1 NOVEL AMIDE DERIVATIVE AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2011-09-14 EP 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-20110263571-A1 NOVEL AMIDE DERIVATIVE AND USE THEREOF AS MEDICINE MMP9, MMP10, MMP2 PIK3CA 4648/4885PIK3C3 1410/4885SLC6A9 446/4885

“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.