SCHEMBL6152574

SCHEMBL6152574

CCOC(=O)c1c[nH]nc1NC1CC(C)(c2ccc(I)cc2)OC1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.35
ADORA2B P29275 4/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
OPRM1 P35372 1/20 0.32
PDE4B Q07343 1/20 0.32
CASP1 P29466 1/20 0.32
PLAT P00750 1/20 0.32
KDM4E B2RXH2 2/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
APEX1 P27695 1/20 0.31
ESR2 Q92731 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL6291829 0.89 JAK2 (0.40) KMT2AMEN1KDM4ELMNATDP1
SCHEMBL6153355 0.87
SCHEMBL6152278 0.85 ALDH1A1 (0.45) MAPK1KMT2AMEN1CASP1KDM4E
SCHEMBL6288883 0.84 SLC26A6 (0.37) KDM4ETDP1FOSJUNNFKB1
SCHEMBL6288861 0.79 ALOX15 (0.39) KDM4ELMNAPOLB
SCHEMBL6291868 0.77 KMT2A (0.36) KMT2AMEN1KDM4ELMNAPOLB
SCHEMBL6585426 0.75 HPGDS (0.33) KDM4ELMNAJAK3
SCHEMBL6291852 0.75 CNR2 (0.35) CYP1A2CYP2C9CYP2C19KMT2AMEN1
SCHEMBL6153084 0.73 CYP2C9 (0.36) CYP2C9MAPK1KMT2AMEN1
SCHEMBL6582104 0.70 IDO1 (0.34) MAPK1KMT2AMEN1CASP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6943181-B2 Use of substituted gamma-lactone compounds as pharmaceutical preparations GRUNENTHAL GMBH (DE) 2005-09-13 US claimed
EP-1406610-B1 USE OF SUBSTITUTED GAMMA-LACTONE COMPOUNDS AS MEDICAMENTS GRUENENTHAL GMBH (DE) 2005-01-26 EP claimed
US-20040176394-A1 Use of substituted gamma-lactone compounds as pharmaceutical preparations GRUNENTHAL GMBH (DE) 2004-09-09 US claimed
US-6943181-B2 Use of substituted gamma-lactone compounds as pharmaceutical preparations GRUNENTHAL GMBH (DE) 2005-09-13 US disclosed
US-20040176394-A1 Use of substituted gamma-lactone compounds as pharmaceutical preparations GRUNENTHAL GMBH (DE) 2004-09-09 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-20040176394-A1 Use of substituted gamma-lactone compounds as pharmaceutical preparations BACE1, MYC, APP SYK 1433/4885ADORA2B 2344/4885CYP1A2 3331/4885

“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.