SCHEMBL5332121

SCHEMBL5332121

COc1ccc2c(c1)cc(-c1cccc3c1C(=O)NC3=O)n2C(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 11/20 0.47
BRD4 O60885 2/20 0.46
CREBBP Q92793 2/20 0.46
ATR Q13535 1/20 0.43
ATRIP Q8WXE1 1/20 0.43
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
NR1H3 Q13133 3/20 0.38
AKR1C3 P42330 1/20 0.38
AKR1C2 P52895 1/20 0.38
PIM1 P11309 1/20 0.37
PIM2 Q9P1W9 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
SCHEMBL5459321 0.86 KDM4E (0.41) BRD4CREBBPAKR1C3AKR1C2
SCHEMBL14448349 0.86 NR1H2 (0.44) NR1H2BRD4CREBBPATRATRIP
SCHEMBL5333314 0.85 KDR (0.52) NR1H2BRD4CREBBPATRATRIP
SCHEMBL5327142 0.78 NR1H2 (0.51) NR1H2BRD4CREBBPATRATRIP
SCHEMBL5327155 0.75 ATR (0.42) NR1H2BRD4CREBBPATRATRIP
SCHEMBL30077038 0.74 NR1H2 (0.49) NR1H2ATRATRIPCA12CA9
SCHEMBL3048742 0.74 NR1H2 (0.53) NR1H2BRD4CREBBPCA12CA9
SCHEMBL12685165 0.73 AKR1C3 (0.57) NR1H2ATRATRIPAKR1C3AKR1C2
SCHEMBL3046139 0.73 NR1H2 (0.42) NR1H2BRD4CREBBPATRATRIP
SCHEMBL5327530 0.73 AURKA (0.48) NR1H2BRD4CREBBPCA12CA9

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 NR1H2 640/4885BRD4 986/4885CREBBP 1222/4885

“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.