SCHEMBL6524399

SCHEMBL6524399

O=C(O)c1cccn(Cc2ccc(Cl)cc2)c1=O

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
VEGFA P15692 1/20 0.65
EGLN1 Q9GZT9 1/20 0.65
CNR1 P21554 1/20 0.60
CNR2 P34972 1/20 0.60
KDM4E B2RXH2 5/20 0.57
BRD4 O60885 2/20 0.57
BRD2 P25440 1/20 0.57
BRD3 Q15059 1/20 0.57
BRDT Q58F21 1/20 0.57
MAPT P10636 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
RAB9A P51151 1/20 0.56
THRB P10828 1/20 0.55
TP53 P04637 1/20 0.55
ALDH1A1 P00352 4/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
HTT P42858 2/20 0.51
LMNA P02545 1/20 0.51

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
SCHEMBL1137531 0.89 BRD4 (0.70) CNR1CNR2KDM4EBRD4BRD2
SCHEMBL4438827 0.88 BRD4 (0.55) VEGFAEGLN1CNR1CNR2KDM4E
SCHEMBL2621620 0.88 CNR1 (0.60) CNR1CNR2KDM4EBRD4BRD2
Hydrochloric Acid SCHEMBL11454825 0.87 BRD4 (0.68) CNR1CNR2KDM4EBRD4BRD2
SCHEMBL19787909 0.86 MAPT (0.60) KDM4EBRD4BRD2BRD3BRDT
SCHEMBL4993019 0.86 BRD4 (0.59) CNR1CNR2KDM4EBRD4BRD2
SCHEMBL4992892 0.86 BRD4 (0.68) CNR1CNR2KDM4EBRD4BRD2
SCHEMBL4437360 0.86 BRD4 (0.56) VEGFAEGLN1CNR1CNR2KDM4E
SCHEMBL3349244 0.85 EGLN1 (0.68) EGLN1KDM4EBRD4BRD2BRD3
SCHEMBL3353651 0.85 KDM4E (0.63) VEGFAEGLN1KDM4EBRD4BRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9873693-B2 Methods of treatment using pyridinonyl PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2018-01-23 US disclosed
US-9873693-B2 Methods of treatment using pyridinonyl PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2018-01-23 US disclosed
US-8778977-B2 Pyridinonyl PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2014-07-15 US disclosed
US-8778977-B2 Pyridinonyl PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2014-07-15 US disclosed
US-20110053931-A1 QUINOLINE COMPOUNDS AND METHODS OF USE GAUDINO JOHN 2011-03-03 US disclosed
US-20100144730-A1 PYRIDINONYL PDK1 INHIBITORS SUNESIS PHAMACEUTICALS (US) 2010-06-10 US disclosed
US-20100144730-A1 PYRIDINONYL PDK1 INHIBITORS SUNESIS PHAMACEUTICALS (US) 2010-06-10 US disclosed
CN-101528702-A Quinoline compounds and methods of use ARRAY BIOPHARMA INC (US) 2009-09-09 CN 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 (2 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-20100144730-A1 PYRIDINONYL PDK1 INHIBITORS PDK1, PDK2, PDK3 VEGFA 4126/4885EGLN1 1028/4885CNR1 3952/4885
US-20110053931-A1 QUINOLINE COMPOUNDS AND METHODS OF USE TK1, ABL1, ROR1 VEGFA 2199/4885EGLN1 3923/4885CNR1 335/4885

“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.