SCHEMBL6004475

SCHEMBL6004475

CCOC(=O)c1ccn(C2CCN(C(=O)OC(C)(C)C)CC2c2cc(-c3ccc(F)cc3)no2)n1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.42
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ENPP2 Q13822 2/20 0.38
GPR119 Q8TDV5 2/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
JAK2 O60674 3/20 0.37
JAK1 P23458 3/20 0.37
PKM P14618 1/20 0.37
BTK Q06187 1/20 0.36
F2RL1 P55085 1/20 0.36

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
SCHEMBL4761315 0.82 NR1H2 (0.46) USP30HPGDKDM4EALDH1A1ENPP2
SCHEMBL4814440 0.82 USP30 (0.42) USP30HPGDKDM4EALDH1A1ENPP2
SCHEMBL30730621 0.76 GPR119 (0.53) USP30ENPP2GPR119HDAC1HDAC2
SCHEMBL14635882 0.73 GPR119 (0.48) HPGDKDM4EALDH1A1GPR119PKM
SCHEMBL6004484 0.72 MEN1 (0.35) ALDH1A1GPR119JAK2JAK1
SCHEMBL27161159 0.72 GPR119 (0.41) HPGDKDM4EALDH1A1GPR119
SCHEMBL27161150 0.72 GPR119 (0.41) HPGDKDM4EALDH1A1GPR119
SCHEMBL4721165 0.72 ALDH1A1 (0.42) HPGDKDM4EALDH1A1ENPP2GPR119
SCHEMBL6003951 0.71 NR1H2 (0.47) USP30HPGDENPP2HDAC1HDAC2
SCHEMBL31227749 0.71 ALDH1A1 (0.50) HPGDKDM4EALDH1A1GPR119

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-20060252807-A1 Novel ortho-terphenyl inhibitors of p38 kinase and methods of treating inflammatory disorders KALYPSYS, INC. 2006-11-09 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-20060252807-A1 Novel ortho-terphenyl inhibitors of p38 kinase and methods of treating inflammatory disorders MAPK1, MAP3K1, MAPK4 USP30 1591/4885HPGD 2186/4885KDM4E 3178/4885

“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.