SCHEMBL5330620

SCHEMBL5330620

CC(C)(C)OC(=O)n1c(-c2cccc3c2C(=O)NC3)cc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.55
CREBBP Q92793 1/20 0.55
NR1H2 P55055 18/20 0.52
CA12 O43570 1/20 0.48
CA9 Q16790 1/20 0.48
NR1H3 Q13133 4/20 0.47

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
SCHEMBL5327530 0.89 AURKA (0.48) BRD4CREBBPNR1H2CA12CA9
SCHEMBL5333314 0.88 KDR (0.52) BRD4CREBBPNR1H2CA12CA9
SCHEMBL3840197 0.85 BRD4 (0.47) BRD4CREBBPNR1H2CA12CA9
SCHEMBL5328430 0.84 AURKA (0.55) BRD4CREBBPNR1H2NR1H3
SCHEMBL3834970 0.84 BRD4 (0.46) BRD4CREBBPNR1H2CA12CA9
SCHEMBL3034386 0.83 BRD4 (0.51) BRD4CREBBPNR1H2CA12CA9
SCHEMBL3043809 0.82 NR1H2 (0.41) BRD4CREBBPNR1H2NR1H3
SCHEMBL27755761 0.81 NR1H2 (0.57) BRD4CREBBPNR1H2CA12CA9
SCHEMBL5315294 0.80 AURKA (0.59) NR1H2
SCHEMBL5335112 0.79 AURKA (0.60) BRD4CREBBPNR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070161648-A1 Substituted dihydro-isoindolones useful in treating kinase disorders JANSSEN PHARMACEUTICA, N.V. (BE) 2007-07-12 US claimed
WO-2007047646-A2 SUBSTITUTED DIHYDRO-ISOINDOLONES USEFUL IN TREATING KINASE DISORDERS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-04-26 WO claimed
US-20070161648-A1 Substituted dihydro-isoindolones useful in treating kinase disorders JANSSEN PHARMACEUTICA, N.V. (BE) 2007-07-12 US disclosed
US-20070161648-A1 Substituted dihydro-isoindolones useful in treating kinase disorders JANSSEN PHARMACEUTICA, N.V. (BE) 2007-07-12 US disclosed
US-20070161648-A1 Substituted dihydro-isoindolones useful in treating kinase disorders JANSSEN PHARMACEUTICA, N.V. (BE) 2007-07-12 US disclosed
WO-2007047646-A2 SUBSTITUTED DIHYDRO-ISOINDOLONES USEFUL IN TREATING KINASE DISORDERS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-04-26 WO disclosed
WO-2007047646-A2 SUBSTITUTED DIHYDRO-ISOINDOLONES USEFUL IN TREATING KINASE DISORDERS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-04-26 WO 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-20070161648-A1 Substituted dihydro-isoindolones useful in treating kinase disorders MAP3K20, MAP3K3, MAP3K19 BRD4 986/4885CREBBP 1222/4885NR1H2 640/4885

“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.