SCHEMBL15468172

SCHEMBL15468172

C=C1CCC(N2C(=O)c3cccc(CN(C)C(=O)c4cccnc4)c3C2=O)C(=O)N1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 17/20 0.48
DDB1 Q16531 16/20 0.48
IKZF3 Q9UKT9 2/20 0.41
TNF P01375 1/20 0.41
IL1B P01584 1/20 0.41
TBXA2R P21731 1/20 0.41
IKZF1 Q13422 1/20 0.41
IKZF2 Q9UKS7 1/20 0.39
BRD7 Q9NPI1 1/20 0.38
ALDH1A1 P00352 1/20 0.37
CHRM2 P08172 1/20 0.37
OPRM1 P35372 1/20 0.37
CYP1A2 P05177 1/20 0.37
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
BRD9 Q9H8M2 1/20 0.37

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
SCHEMBL15468273 0.92 DDB1 (0.58) CRBNDDB1IKZF3TNFIL1B
SCHEMBL15468176 0.91 DDB1 (0.52) CRBNDDB1IKZF3TNFIL1B
SCHEMBL15468173 0.86 DDB1 (0.49) CRBNDDB1IKZF3TNFIL1B
SCHEMBL15468184 0.85 DDB1 (0.47) CRBNDDB1IKZF3TNFIL1B
SCHEMBL15468178 0.83 DDB1 (0.53) CRBNDDB1IKZF3TNFIL1B
SCHEMBL15468186 0.82 DDB1 (0.49) CRBNDDB1IKZF3TNFIL1B
SCHEMBL15468278 0.82 DDB1 (0.64) CRBNDDB1IKZF3TNFIL1B
SCHEMBL15468175 0.82 DDB1 (0.52) CRBNDDB1IKZF3TNFIL1B
SCHEMBL15468174 0.81 DDB1 (0.49) CRBNDDB1IKZF3TNFIL1B
SCHEMBL15468179 0.80 DDB1 (0.52) CRBNDDB1IKZF3TNFIL1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140314752-A1 METHODS FOR TREATING CANCER USING TOR KINASE INHIBITOR COMBINATION THERAPY SIGNAL PHARMACEUTICALS, LLC (US) 2014-10-23 US disclosed
US-8648096-B2 N-methylaminomethyl isoindole compounds and compositions comprising and methods of using the same CELGENE CORPORATION (US) 2014-02-11 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-20140314752-A1 METHODS FOR TREATING CANCER USING TOR KINASE INHIBITOR COMBINATION THERAPY MTOR, ULK1, RICTOR CRBN 869/4885DDB1 820/4885IKZF3 355/4885

“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.