SCHEMBL1504668

SCHEMBL1504668

CONC(=O)c1ccc(Br)c(NC(=O)c2ccc(=O)n(-c3c(F)cccc3F)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.42
HDAC8 Q9BY41 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42
RAB9A P51151 5/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
BCHE P06276 1/20 0.39
CYP1A2 P05177 1/20 0.39
MAPK14 Q16539 1/20 0.38
KMT2A Q03164 3/20 0.38
F10 P00742 2/20 0.38
MEN1 O00255 2/20 0.38
TP53 P04637 1/20 0.38
ALDH1A1 P00352 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PDE4D Q08499 1/20 0.36
NPC1 O15118 3/20 0.36
POLB P06746 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL1504623 0.89 MAPK14 (0.43) HDAC1HDAC8HDAC6RAB9ASMN1; SMN2
SCHEMBL1504699 0.86 HDAC1 (0.46) HDAC1HDAC8HDAC6RAB9ABCHE
SCHEMBL1504566 0.86 HDAC1 (0.49) HDAC1HDAC8HDAC6RAB9ASMN1; SMN2
SCHEMBL1504789 0.83 MAPK14 (0.47) HDAC1HDAC8HDAC6CYP1A2MAPK14
SCHEMBL1504764 0.83 HDAC1 (0.39) HDAC1HDAC8HDAC6RAB9ASMN1; SMN2
SCHEMBL1504645 0.82 NPC1 (0.47) HDAC1HDAC8HDAC6RAB9ASMN1; SMN2
SCHEMBL1504703 0.82 MAPK14 (0.47) HDAC1HDAC8HDAC6RAB9ABCHE
SCHEMBL1504594 0.81 KDM4E (0.46) HDAC1HDAC8HDAC6RAB9ASMN1; SMN2
SCHEMBL1504763 0.81 CYP11B1 (0.52) SMN1; SMN2CYP1A2MAPK14KMT2AF10
SCHEMBL1504662 0.81 MAPK14 (0.47) HDAC1HDAC8HDAC6RAB9ASMN1; SMN2

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-8173684-B2 Pyridone derivatives as p38α MAPK inhibitors ASTELLAS PHARMA INC. (JP) 2012-05-08 US disclosed
US-8173684-B2 Pyridone derivatives as p38α MAPK inhibitors ASTELLAS PHARMA INC. (JP) 2012-05-08 US disclosed
US-8173684-B2 Pyridone derivatives as p38α MAPK inhibitors ASTELLAS PHARMA INC. (JP) 2012-05-08 US disclosed
EP-2155683-B1 PYRIDONE DERIVATIVES AS P38A MAPK INHIBITORS ASTELLAS PHARMA INC (JP) 2011-03-16 EP disclosed
US-20100063098-A1 PYRIDONE DERIVATIVES AS P38A MAPK INHIBITORS ASTELLAS PHARMA INC. (JP) 2010-03-11 US disclosed
US-20100063098-A1 PYRIDONE DERIVATIVES AS P38A MAPK INHIBITORS ASTELLAS PHARMA INC. (JP) 2010-03-11 US disclosed
US-20100063098-A1 PYRIDONE DERIVATIVES AS P38A MAPK INHIBITORS ASTELLAS PHARMA INC. (JP) 2010-03-11 US 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-20100063098-A1 PYRIDONE DERIVATIVES AS P38A MAPK INHIBITORS MAPK1, MAPK6, MAPK3 HDAC1 777/4885HDAC8 1531/4885HDAC6 2198/4885

“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.