SCHEMBL20118479

SCHEMBL20118479

CCCC(=O)NCc1cccc2c1C(=O)N([C@H]1CCC(=O)NC1=O)C2=O

nearest known ligand 0.79

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 17/20 0.79
CRBN Q96SW2 17/20 0.79
IKZF3 Q9UKT9 2/20 0.56
TNF P01375 1/20 0.56
IL1B P01584 1/20 0.56
TBXA2R P21731 1/20 0.56
IKZF1 Q13422 1/20 0.56
ALDH1A1 P00352 1/20 0.53
CHRM2 P08172 1/20 0.53
OPRM1 P35372 1/20 0.53
CYP1A2 P05177 1/20 0.53
TSHR P16473 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
STAT3 P40763 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC2 Q92769 1/20 0.49

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
SCHEMBL20118388 1.00 DDB1 (0.79) DDB1CRBNIKZF3TNFIL1B
SCHEMBL1424775 1.00 DDB1 (0.79) DDB1CRBNIKZF3TNFIL1B
SCHEMBL31563747 0.94 DDB1 (0.75) DDB1CRBNIKZF3TNFIL1B
SCHEMBL29808178 0.93 CRBN (0.73) DDB1CRBNIKZF3TNFIL1B
SCHEMBL2381344 0.93 CRBN (0.73) DDB1CRBNIKZF3TNFIL1B
SCHEMBL501757 0.93 CRBN (0.73) DDB1CRBNIKZF3TNFIL1B
SCHEMBL476960 0.92 DDB1 (0.81) DDB1CRBNIKZF3TNFIL1B
SCHEMBL30041341 0.92 DDB1 (0.81) DDB1CRBNIKZF3TNFIL1B
SCHEMBL19008357 0.91 DDB1 (0.66) DDB1CRBNIKZF3TNFIL1B
SCHEMBL2384835 0.91 DDB1 (0.77) DDB1CRBNIKZF3TNFIL1B

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-20180118712-A1 2',6'-DIOXO-3'-DEUTERO-PIPERDIN-3-YL-ISOINDOLINE COMPOUNDS DEUTERX LLC (US) 2018-05-03 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-20180118712-A1 2',6'-DIOXO-3'-DEUTERO-PIPERDIN-3-YL-ISOINDOLINE COMPOUNDS AVPR2, PKD2, DYNC1I2 DDB1 3409/4885CRBN 4405/4885IKZF3 928/4885

“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.