SCHEMBL4560562

SCHEMBL4560562

CCOC(=O)c1ccc(Nc2nc(-c3c(C)nc4ccc(C(F)(F)F)cn34)cs2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD3 O94806 1/20 0.48
MAP4K4 O95819 1/20 0.48
PIM1 P11309 1/20 0.48
RPS6KB1 P23443 1/20 0.48
CDK2 P24941 1/20 0.48
FLT4 P35916 1/20 0.48
FLT3 P36888 1/20 0.48
MAPK8 P45983 1/20 0.48
MAPK9 P45984 1/20 0.48
CSNK1D P48730 1/20 0.48
GSK3A P49840 1/20 0.48
GSK3B P49841 1/20 0.48
CSNK2A1 P68400 1/20 0.48
DYRK1A Q13627 1/20 0.48
TAOK1 Q7L7X3 1/20 0.48
PIM3 Q86V86 1/20 0.48
PRKD2 Q9BZL6 1/20 0.48
HIPK2 Q9H2X6 1/20 0.48
CLK4 Q9HAZ1 1/20 0.48
IRAK4 Q9NWZ3 1/20 0.48

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
SCHEMBL3689603 0.88 HDAC6 (0.55) PRKD3MAP4K4PIM1RPS6KB1CDK2
SCHEMBL12789885 0.88 GAA (0.55) PRKD3MAP4K4PIM1RPS6KB1CDK2
SCHEMBL3809864 0.88 CFTR (0.56) PRKD3MAP4K4PIM1RPS6KB1CDK2
SCHEMBL12790466 0.88 PRKD3 (0.51) PRKD3MAP4K4PIM1RPS6KB1CDK2
SCHEMBL12789862 0.87 PRKD3 (0.50) PRKD3MAP4K4PIM1RPS6KB1CDK2
SCHEMBL13948946 0.86 PRKD3 (0.48) PRKD3MAP4K4PIM1RPS6KB1CDK2
SCHEMBL12790057 0.83 PRKD3 (0.70) PRKD3MAP4K4PIM1RPS6KB1CDK2
SCHEMBL7980219 0.83 KDR (0.48) CDK2GSK3BMAPTMEN1KMT2A
SCHEMBL12790468 0.82 PRKD3 (0.50) PRKD3MAP4K4PIM1RPS6KB1CDK2
SCHEMBL12297489 0.81 ALOX5 (0.60) CSNK2A1MAPTKDM4ESMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110052527-A1 IMIDAZOPYRIDINYL THIAZOLYL HISTONE DEACETYLASE INHIBITORS GILEAD SCIENCES, INC. (US) 2011-03-03 US disclosed
US-20110052527-A1 IMIDAZOPYRIDINYL THIAZOLYL HISTONE DEACETYLASE INHIBITORS GILEAD SCIENCES, INC. (US) 2011-03-03 US disclosed
US-20090005374-A1 IMIDAZOPYRIDINYL THIAZOLYL HISTONE DEACETYLASE INHIBITORS GILEAD SCIENCES, INC. 2009-01-01 US disclosed
US-20090005374-A1 IMIDAZOPYRIDINYL THIAZOLYL HISTONE DEACETYLASE INHIBITORS GILEAD SCIENCES, INC. 2009-01-01 US disclosed
US-20090005374-A1 IMIDAZOPYRIDINYL THIAZOLYL HISTONE DEACETYLASE INHIBITORS GILEAD SCIENCES, INC. 2009-01-01 US disclosed
WO-2009002534-A1 IMIDAZOPYRIDINYL THIAZOLYL HISTONE DEACETYLASE INHIBITORS GILEAD COLORADO, INC. (US) 2008-12-31 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 (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-20090005374-A1 IMIDAZOPYRIDINYL THIAZOLYL HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC8, HDAC5 PRKD3 1100/4885MAP4K4 408/4885PIM1 1556/4885
US-20110052527-A1 IMIDAZOPYRIDINYL THIAZOLYL HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC8, HDAC5 PRKD3 1100/4885MAP4K4 408/4885PIM1 1556/4885

“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.