SCHEMBL2019496

SCHEMBL2019496

COC(=O)c1cccc(-c2ccc(OCCC(C)(C)F)cc2C)c1C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.42
DRD1 P21728 1/20 0.40
PDCD1 Q15116 3/20 0.40
CD274 Q9NZQ7 3/20 0.40
PTPN11 Q06124 1/20 0.38
FFAR1 O14842 1/20 0.37
PDK2 Q15119 8/20 0.37
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 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
SCHEMBL12577723 0.90 PDCD1 (0.40) FFAR4DRD1PDCD1CD274PTPN11
SCHEMBL2022751 0.80 CD274 (0.40) FFAR4PDCD1CD274FFAR1PDK2
SCHEMBL9934610 0.78 FFAR1 (0.43) PDCD1CD274FFAR1MAPT
SCHEMBL12578187 0.77 PARP10 (0.41) PDCD1CD274FFAR1
SCHEMBL2909981 0.76 DRD1 (0.40) DRD1PDCD1CD274KDM4ECYP1A2
SCHEMBL13117432 0.75 MAPT (0.41) PDCD1CD274KDM4ECYP1A2MAPT
SCHEMBL12640975 0.73 CA12 (0.49) FFAR4PDK2CYP3A4MAPT
SCHEMBL12577725 0.73 PDCD1 (0.36) PDCD1CD274KDM4EMAPT
SCHEMBL12578210 0.73 FFAR1 (0.39) FFAR4PDCD1CD274FFAR1MAPT
SCHEMBL13139887 0.73 CNR1 (0.41) FFAR4FFAR1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968552-B2 Oxadiazolidinedione compound ASTELLAS PHARMA INC. (JP) 2011-06-28 US disclosed
US-20090186909-A1 Oxadiazolidinedione Compound ASTELLAS PHARMA INC. (JP) 2009-07-23 US disclosed
EP-2011788-A1 OXADIAZOLIDINEDIONE COMPOUND Astellas Pharma Inc. (JP) 2009-01-07 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-20090186909-A1 Oxadiazolidinedione Compound GPR119, GPR39, GPR65 FFAR4 54/4885DRD1 262/4885PDCD1 2193/4885

“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.