SCHEMBL5328430

SCHEMBL5328430

CC(C)(C)OC(=O)n1c(-c2cccc3c2C(=O)NC3)cc2cc(OCc3ccccc3)ccc21

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AURKA O14965 7/20 0.55
KDR P35968 7/20 0.55
NR1H2 P55055 7/20 0.42
BRD4 O60885 1/20 0.41
CREBBP Q92793 1/20 0.41
SRD5A2 P31213 1/20 0.41
NR1H3 Q13133 1/20 0.40
GHSR Q92847 4/20 0.39

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
SCHEMBL5334220 0.91 AURKA (0.46) AURKAKDRNR1H2BRD4CREBBP
SCHEMBL5333314 0.87 KDR (0.52) AURKAKDRNR1H2BRD4CREBBP
SCHEMBL5331995 0.86 AURKA (0.42) AURKAKDRNR1H2BRD4CREBBP
SCHEMBL5327530 0.85 AURKA (0.48) AURKAKDRNR1H2BRD4CREBBP
SCHEMBL5315294 0.84 AURKA (0.59) AURKAKDRNR1H2
SCHEMBL5330620 0.84 BRD4 (0.55) NR1H2BRD4CREBBPNR1H3
SCHEMBL5332483 0.84 NR1H2 (0.38) AURKAKDRNR1H2BRD4CREBBP
SCHEMBL5335112 0.83 AURKA (0.60) AURKAKDRNR1H2BRD4CREBBP
SCHEMBL5329167 0.81 AURKA (0.39) AURKAKDRNR1H2BRD4CREBBP
SCHEMBL3043809 0.80 NR1H2 (0.41) AURKAKDRNR1H2BRD4CREBBP

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 AURKA 669/4885KDR 1627/4885NR1H2 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.