SCHEMBL5378209

SCHEMBL5378209

O=C(Nc1ccc2c(c1)OCCO2)c1cccc(-c2n[nH]c3ccc(-c4nc[nH]n4)cc23)c1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 0.53
CSNK2A1 P68400 1/20 0.52
RAB9A P51151 10/20 0.48
CSNK1D P48730 1/20 0.48
SMN1; SMN2 Q16637 5/20 0.48
ALDH1A1 P00352 2/20 0.48
TP53 P04637 2/20 0.48
MAPT P10636 2/20 0.47
GAA P10253 1/20 0.47
AURKA O14965 1/20 0.47
HSD17B10 Q99714 1/20 0.46
MAP3K5 Q99683 2/20 0.45
PKM P14618 1/20 0.45
PARP1 P09874 1/20 0.44
CLK2 P49760 1/20 0.44
CLK3 P49761 1/20 0.44
DYRK1A Q13627 1/20 0.44

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
SCHEMBL5398532 0.86 CSNK1D (0.49) CSNK1DAURKAMAP3K5CLK2CLK3
SCHEMBL8254966 0.84 AURKA (0.56) CSNK2A1CSNK1DAURKAMAP3K5CLK2
SCHEMBL5389315 0.84 CSNK1D (0.66) CSNK1DSMN1; SMN2TP53MAPTAURKA
SCHEMBL5380225 0.84 CSNK1D (0.56) CSNK1DAURKAMAP3K5DYRK1A
SCHEMBL8252590 0.84 CSNK1D (0.54) CSNK1DAURKAMAP3K5CLK2CLK3
SCHEMBL5387166 0.82 AURKA (0.63) CSNK1DAURKAMAP3K5CLK2CLK3
SCHEMBL5381379 0.82 CSNK1D (0.55) NPC1RAB9ACSNK1DSMN1; SMN2AURKA
SCHEMBL5378344 0.82 MAP2K4 (0.54) NPC1CSNK2A1RAB9ACSNK1DSMN1; SMN2
SCHEMBL8257301 0.81 DYRK1A (0.53) CSNK1DALDH1A1AURKAMAP3K5CLK2
SCHEMBL2858874 0.81 NPC1 (0.61) NPC1CSNK2A1RAB9ASMN1; SMN2ALDH1A1

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 12 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
EP-1618093-A2 INDAZOLE DERIVATIVES AS JNK INHIBITORS Signal Pharmaceuticals LLC (US) 2006-01-25 EP claimed
WO-2004094388-A2 INDAZOLE DERIVATIVES AS JNK INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2004-11-04 WO claimed
US-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK SIGNAL PHARMACEUTICALS, LLC 2004-07-01 US claimed
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 disclosed
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 disclosed
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds SIGNAL PHARMACEUTICALS, LLC 2007-03-15 US disclosed
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds SIGNAL PHARMACEUTICALS, LLC 2007-03-15 US disclosed
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC 2005-01-13 US disclosed
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC 2005-01-13 US disclosed
US-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK SIGNAL PHARMACEUTICALS, LLC 2004-07-01 US disclosed
US-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK SIGNAL PHARMACEUTICALS, LLC 2004-07-01 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 (3 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 NPC1 1019/4885CSNK2A1 89/4885RAB9A 1630/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT NPC1 152/4885CSNK2A1 1160/4885RAB9A 3346/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R NPC1 818/4885CSNK2A1 183/4885RAB9A 3063/4885

“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.