SCHEMBL5378629

SCHEMBL5378629

COc1c(-c2n[nH]c3ccc(-c4n[nH]c(CC5CC5)n4)cc23)ccc(F)c1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 2/20 0.46
ADORA2A P29274 3/20 0.46
ADORA1 P30542 1/20 0.39
AOC3 Q16853 2/20 0.36
MAPK1 P28482 1/20 0.35
MAP2K4 P45985 1/20 0.35
MAPKAPK2 P49137 1/20 0.35
MAPKAPK3 Q16644 1/20 0.35
MAPK6 Q16659 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
DYRK1A Q13627 4/20 0.35
GSK3B P49841 2/20 0.35
KCNH2 Q12809 2/20 0.35
LYN P07948 1/20 0.35
GRK2 P25098 1/20 0.35
CLK1 P49759 1/20 0.35
GSK3A P49840 1/20 0.35
MAPK7 Q13164 1/20 0.35
DYRK2 Q92630 1/20 0.35

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
SCHEMBL5373481 0.86 CSNK1D (0.44) CSNK1DADORA2AADORA1MAPK1MAP2K4
SCHEMBL5380485 0.82 CSNK1D (0.53) CSNK1DADORA2AAOC3MAPK1MAP2K4
SCHEMBL5378091 0.81 CSNK1D (0.51) CSNK1DADORA2AAOC3MAPK1MAP2K4
SCHEMBL5388496 0.81 ADORA2A (0.58) CSNK1DADORA2AADORA1AOC3CNR1
SCHEMBL5387177 0.80 CSNK1D (0.67) CSNK1DADORA2AAOC3MAPK1MAP2K4
SCHEMBL5378080 0.78 ADORA2A (0.49) CSNK1DADORA2AAOC3MAPK1GSK3B
SCHEMBL5378119 0.77 CSNK1D (0.54) CSNK1DADORA2AAOC3MAPK1CNR1
SCHEMBL5387116 0.76 CSNK1D (0.54) CSNK1DADORA2AMAP2K4DYRK1AGSK3B
SCHEMBL5381667 0.76 CSNK1D (0.68) CSNK1DADORA2AAOC3MAPK1MAP2K4
SCHEMBL5387284 0.76 CSNK1D (0.68) CSNK1DADORA2AAOC3MAPK1MAP2K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7211594-B2 Indazole compounds and compositions thereof as JNK inhibitors and for the treatment of diseases associated therewith SIGNAL PHARMACEUTICALS, LLC (US) 2007-05-01 US claimed
US-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK SIGNAL PHARMACEUTICALS, LLC 2004-07-01 US claimed

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-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK MAPK1, MAP3K1, MAPKAPK2 CSNK1D 349/4885ADORA2A 2524/4885ADORA1 2155/4885

“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.