SCHEMBL6772573

SCHEMBL6772573

COC(Cc1ccc2c(N)ccnc2c1)N1CCN(C(=O)O)CC1=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDE P14735 2/20 0.34
NR4A2 P43354 1/20 0.34
SOS2 Q07890 1/20 0.34
SMYD3 Q9H7B4 2/20 0.33
EHMT2 Q96KQ7 1/20 0.33
EHMT1 Q9H9B1 1/20 0.33
CLK1 P49759 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CCR5 P51681 1/20 0.32
AKT1 P31749 3/20 0.32
MAPT P10636 2/20 0.31
MAPK1 P28482 2/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GLA P06280 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 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
SCHEMBL6772577 1.00 IDE (0.34) IDENR4A2SOS2SMYD3EHMT2
SCHEMBL4387290 0.87 F10 (0.39) AKT1
SCHEMBL4387303 0.87 F10 (0.39) AKT1
SCHEMBL6772570 0.75 NR4A2 (0.32) IDENR4A2SOS2SMYD3EHMT2
SCHEMBL4389177 0.74 F10 (0.40) AKT1
SCHEMBL1652127 0.73 PDGFRB (0.47)
SCHEMBL1386877 0.73 KCNH2 (0.35) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL1386717 0.73 F10 (0.38) AKT1
SCHEMBL7146946 0.72 F10 (0.44) AKT1
SCHEMBL7146953 0.72 F10 (0.44) AKT1

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-20040102450-A1 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2004-05-27 US claimed

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-20040102450-A1 Substituted oxoazaheterocyclyl compounds F13B, F9, F11 IDE 144/4885NR4A2 3595/4885SOS2 1629/4885

“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.